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4-Hydroxypyrazolo[3,4-d]pyrimidine

CAS 315-30-0C5H4N4OMW 136.11

4-Hydroxypyrazolo[3,4-d]pyrimidine(CAS 315-30-0):分子式 C5H4N4O、分子量 136.11;类别 有机化学品。

规格参数

CAS号315-30-0
分子式C5H4N4O
分子量136.11
熔点>300
沸点250.36
LogP-1.8
应用领域Uses: MEDICATION、MEDICATION (Vet):、THERAPEUTIC CATEGORY: Treatment of hyperuricemia and chronic gout、antiurolithic.、Use (kg) in Switzerland (2009): >5000、Use (kg、approx.) in Germany (2009): >100000、Use (kg) in USA (2002): 59900、Use (kg) in France (2004): 54247、Consumption (g per capita) in Switzerland (2009): 0.64、Consumption (g per capita、approx.) in Germany (2009): 1.2、Consumption (g per capita) in the USA (2002): 0.21、Consumption (g per capita) in France (2004): 0.9、Excretion rate: 0.28、Calculated removal (%): 75.1、For the treatment of hyperuricemia associated with primary or secondary gout. Also indicated for the treatment of primary or secondary uric acid nephropathy、with or without the symptoms of gout、as well as chemotherapy-induced hyperuricemia and recurrent renal calculi.、Methods of Manufacturing: Reaction of malononitrile and triethyl orthoformate to form ethoxymethylene malononitrile which is reacted with hydrazine、hydrolyzed、and condensed with formamide.、(Ethoxymethylene)malononitrile is reacted with hydrazine hydrate via deethanolation and addition thus cyclizing to form 3-aminopyrazole-4-carbonitrile. Controlled hydration of nitrile forms the corresponding carboxamide which、on condensation with formamide、yields allopurinol.、Formulations、Preparations: Allopurinol Preparations: (AHFS、2009)、Table: Allopurinol Preparations: (AHFS、2009) [Table#4346]、Oral Tablets、100 mg、Lopurin (scored)、Boots、Zyloprim (with povidone、scored)、Burroughs Wellcome、300 mg、Burroughs Wellcome.、Tablets、100 and 300 mg、Consumption Patterns: Essentially 100% as a uricosuric agent、U.S. Production: (1977) Probably > 4.54 x 10+5 g、(1978) Probably > 4.54 x 10+5 g、Production volumes for non-confidential chemicals reported under the Inventory Update Rule. [Table#4347]、[US EPA、Non-confidential Production Volume Information Submitted by Companies for Chemicals Under the 1986-2002 Inventory Update Rule (IUR). 4H-Pyrazolo、General Manufacturing Information: 4H-Pyrazolo[3、4-d]pyrimidin-4-one、1、5-dihydro-: ACTIVE
类别Organic Chemicals

用途与场景

登记用途:Uses: MEDICATION、MEDICATION (Vet):、THERAPEUTIC CATEGORY: Treatment of hyperuricemia and chronic gout、antiurolithic.、Use (kg) in Switzerland (2009): >5000、Use (kg、approx.) in Germany (2009): >100000、Use (kg) in USA (2002): 59900、Use (kg) in France (2004): 54247、Consumption (g per capita) in Switzerland (2009): 0.64、Consumption (g per capita、approx.) in Germany (2009): 1.2、Consumption (g per capita) in the USA (2002): 0.21、Consumption (g per capita) in France (2004): 0.9、Excretion rate: 0.28、Calculated removal (%): 75.1、For the treatment of hyperuricemia associated with primary or secondary gout. Also indicated for the treatment of primary or secondary uric acid nephropathy、with or without the symptoms of gout、as well as chemotherapy-induced hyperuricemia and recurrent renal calculi.、Methods of Manufacturing: Reaction of malononitrile and triethyl orthoformate to form ethoxymethylene malononitrile which is reacted with hydrazine、hydrolyzed、and condensed with formamide.、(Ethoxymethylene)malononitrile is reacted with hydrazine hydrate via deethanolation and addition thus cyclizing to form 3-aminopyrazole-4-carbonitrile. Controlled hydration of nitrile forms the corresponding carboxamide which、on condensation with formamide、yields allopurinol.、Formulations、Preparations: Allopurinol Preparations: (AHFS、2009)、Table: Allopurinol Preparations: (AHFS、2009) [Table#4346]、Oral Tablets、100 mg、Lopurin (scored)、Boots、Zyloprim (with povidone、scored)、Burroughs Wellcome、300 mg、Burroughs Wellcome.、Tablets、100 and 300 mg、Consumption Patterns: Essentially 100% as a uricosuric agent、U.S. Production: (1977) Probably > 4.54 x 10+5 g、(1978) Probably > 4.54 x 10+5 g、Production volumes for non-confidential chemicals reported under the Inventory Update Rule. [Table#4347]、[US EPA、Non-confidential Production Volume Information Submitted by Companies for Chemicals Under the 1986-2002 Inventory Update Rule (IUR). 4H-Pyrazolo、General Manufacturing Information: 4H-Pyrazolo[3、4-d]pyrimidin-4-one、1、5-dihydro-: ACTIVE。

采购档案

这个产品是什么

4-Hydroxypyrazolo[3,4-d]pyrimidine 是一种以碳骨架为基础的有机化合物,登记 CAS 号为 315-30-0,分子式 C5H4N4O(分子量 136.11),归属于有机化学品大类化工原料。

识别信息

登记 CAS 号:315-30-0

其分子式 C5H4N4O 由 5 个碳、4 个氢、4 个氮、1 个氧 组成。

别名/同义词:4-Hydroxypyrazolo[3,4-d]pyrimidine · Allopurinol

所属分类:有机化学品

常见问题

4-Hydroxypyrazolo[3,4-d]pyrimidine 的 CAS 号是多少?

4-Hydroxypyrazolo[3,4-d]pyrimidine 的 CAS 登记号为 315-30-0。

4-Hydroxypyrazolo[3,4-d]pyrimidine 的分子式与分子量是多少?

分子式 C5H4N4O,分子量 136.11。

4-Hydroxypyrazolo[3,4-d]pyrimidine 还有哪些别名?

别名/同义词:4-Hydroxypyrazolo[3,4-d]pyrimidine、Allopurinol。

4-Hydroxypyrazolo[3,4-d]pyrimidine 的登记用途是什么?

登记用途:Uses: MEDICATION、MEDICATION (Vet):、THERAPEUTIC CATEGORY: Treatment of hyperuricemia and chronic gout、antiurolithic.、Use (kg) in Switzerland (2009): >5000、Use (kg、approx.) in Germany (2009): >100000、Use (kg) in USA (2002): 59900、Use (kg) in France (2004): 54247、Consumption (g per capita) in Switzerland (2009): 0.64、Consumption (g per capita、approx.) in Germany (2009): 1.2、Consumption (g per capita) in the USA (2002): 0.21、Consumption (g per capita) in France (2004): 0.9、Excretion rate: 0.28、Calculated removal (%): 75.1、For the treatment of hyperuricemia associated with primary or secondary gout. Also indicated for the treatment of primary or secondary uric acid nephropathy、with or without the symptoms of gout、as well as chemotherapy-induced hyperuricemia and recurrent renal calculi.、Methods of Manufacturing: Reaction of malononitrile and triethyl orthoformate to form ethoxymethylene malononitrile which is reacted with hydrazine、hydrolyzed、and condensed with formamide.、(Ethoxymethylene)malononitrile is reacted with hydrazine hydrate via deethanolation and addition thus cyclizing to form 3-aminopyrazole-4-carbonitrile. Controlled hydration of nitrile forms the corresponding carboxamide which、on condensation with formamide、yields allopurinol.、Formulations、Preparations: Allopurinol Preparations: (AHFS、2009)、Table: Allopurinol Preparations: (AHFS、2009) [Table#4346]、Oral Tablets、100 mg、Lopurin (scored)、Boots、Zyloprim (with povidone、scored)、Burroughs Wellcome、300 mg、Burroughs Wellcome.、Tablets、100 and 300 mg、Consumption Patterns: Essentially 100% as a uricosuric agent、U.S. Production: (1977) Probably > 4.54 x 10+5 g、(1978) Probably > 4.54 x 10+5 g、Production volumes for non-confidential chemicals reported under the Inventory Update Rule. [Table#4347]、[US EPA、Non-confidential Production Volume Information Submitted by Companies for Chemicals Under the 1986-2002 Inventory Update Rule (IUR). 4H-Pyrazolo、General Manufacturing Information: 4H-Pyrazolo[3、4-d]pyrimidin-4-one、1、5-dihydro-: ACTIVE。

4-Hydroxypyrazolo[3,4-d]pyrimidine 属于哪个分类?

所属分类:Organic Chemicals。

PubChem 公开数据

4-Hydroxypyrazolo[3,4-d]pyrimidine(CAS 315-30-0)的公开数据库记录,列此仅供独立核对。

危险化学品分类与危害说明

Reported hazard statementsH301 (53.1%), H317 (94.4%)

H301 (53.1%): Toxic if swallowed [Danger Acute toxicity, oral]

H317 (94.4%): May cause an allergic skin reaction [Warning Sensitization, Skin]

物理形态与操作说明

  • 4-hydroxypyrazolo(3,4-d)pyrimidine is an odorless tasteless white microcrystalline powder. (NTP, 1992)
  • Solid
  • FLUFFY WHITE TO OFF-WHITE POWDER
  • Crystals
  • SLIGHT
  • TASTELESS

公开数据库收录的理化数据

沸点250.36
熔点>300
熔点350 °C
溶解度In water, 569 mg/L at 25 °C
溶解度5.88e+00 g/L
LogP-1.8
LogPlog Kow = -0.55
LogP-1
LogP-0.55
Dissociation Constants10.2 (at 25℃)

这个物质在各数据库里的编号

CAS Registry Number315-30-0
PubChem CID135401907
分子式C5H4N4O
IUPAC 名称1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one
UNII(FDA)63CZ7GJN5I

数据库记载的用途

  • THERAPEUTIC CATEGORY: Treatment of hyperuricemia and chronic gout, antiurolithic.
  • Use (kg) in Switzerland (2009): >5000
  • Use (kg; approx.) in Germany (2009): >100000
  • Use (kg) in France (2004): 54247
  • Consumption (g per capita) in Switzerland (2009): 0.64
  • Consumption (g per capita; approx.) in Germany (2009): 1.2

它在各数据库里的别名

allopurinol; 315-30-0; 1H-Pyrazolo[3,4-d]pyrimidin-4-ol; Zyloric; Suspendol; Takanarumin; Allopur; Bloxanth; Uriprim; Xanturat; Urbol; Ketobun-A; Nektrohan; Adenock; Aluline; Dabrosin

计算机算出的分子描述符

分子量136.11
XLogP3-0.7
氢键供体数2
氢键受体数3
可旋转键数0
精确质量136.03851076
单同位素质量136.03851076
拓扑极性表面积70.1
重原子数10
形式电荷0

数据库摘要

4-Hydroxypyrazolo[3,4-d]pyrimidine · CAS 315-30-0 · C5H4N4O. UNII 63CZ7GJN5I. 沸点: 250.36; 熔点: >300; 熔点: 350 °C.

数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。

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