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4-Acetyl-6-t-butyl-1,1-dimethylindane

CAS 13171-00-1C17H24OMW 244.18 g/mol

4-Acetyl-6-t-butyl-1,1-dimethylindane(CAS 13171-00-1):分子式 C17H24O、分子量 244.18 g/mol。

规格参数

CAS号13171-00-1
分子式C17H24O
分子量244.18 g/mol
熔点78.5 °C
沸点BP: 304.5 °C at 101.325 kPa
LogPlog Kow = 5.7

采购档案

这个产品是什么

4-Acetyl-6-t-butyl-1,1-dimethylindane 是一种化工化合物,登记 CAS 号为 13171-00-1,分子式 C17H24O(分子量 244.18 g/mol)。

识别信息

登记 CAS 号:13171-00-1

其分子式 C17H24O 由 17 个碳、24 个氢、1 个氧 组成。

别名/同义词:4-Acetyl-6-t-butyl-1,1-dimethylindane · 6-tert-butyl-1,1-dimethylindan-4-yl methyl ketone

常见问题

4-Acetyl-6-t-butyl-1,1-dimethylindane 的 CAS 号是多少?

4-Acetyl-6-t-butyl-1,1-dimethylindane 的 CAS 登记号为 13171-00-1。

4-Acetyl-6-t-butyl-1,1-dimethylindane 的分子式与分子量是多少?

分子式 C17H24O,分子量 244.18 g/mol。

4-Acetyl-6-t-butyl-1,1-dimethylindane 还有哪些别名?

别名/同义词:4-Acetyl-6-t-butyl-1,1-dimethylindane、6-tert-butyl-1,1-dimethylindan-4-yl methyl ketone。

PubChem 公开数据

4-Acetyl-6-t-butyl-1,1-dimethylindane(CAS 13171-00-1)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

GHS notification summary99.5% (1545 / 1553)

This chemical does not meet GHS hazard criteria for 99.5% (1545 of 1553) of all reports.

Reported as not meeting GHS hazard criteria by 1545 of 1553 companies (only 0.5% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

法规与备案状态

Regulatory & Food ContactFDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
Floral
GHS notification summary99.5% (1545 / 1553)

物理形态与操作说明

  • Solid
  • almost white crystals with a musky, sweet, animal odour
  • Almost white crystals
  • Musky, sweet, animal odor
  • Solvent-like with a dirty, musty brown, earthy nuance
  • Insoluble in water

公开数据库收录的理化数据

沸点BP: 304.5 °C at 101.325 kPa
熔点78.5 °C
熔点77.2 - 77.9 °C
溶解度In water, 0.015 mg/L
溶解度In water, 3.29 mg/L at 24 °C
密度1.06 at 21 °C
蒸气压VP: 0.05 Pa at 21 °C (3.75X10-3 mm Hg)
蒸气压1.50X10-4 mm Hg (0.020 Pa)
LogPlog Kow = 5.7

这个物质在各数据库里的编号

CAS Registry Number13171-00-1
PubChem CID61585
分子式C17H24O
分子量244.18 g/mol
IUPAC 名称1-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)ethanone
InChIKeyIKTHMQYJOWTSJO-UHFFFAOYSA-N
UNII(FDA)E1HM68Q21P
ChEBI 编号CHEBI:172483
FEMA 编号3653
JECFA 编号812

数据库记载的用途

  • Musk fragrance ... used for perfuming soap and cosmetics.
  • Flavoring Agents -> JECFA Flavorings Index
  • Ethanone, 1-[6-(1,1-dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-inden-4-yl]-: ACTIVE
  • A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell, especially a fluid containing fragrant natural oils extracted from flowers, woods, etc., or similar synthetic oils. (Random House Unabridged Dictionary, 2d ed)

它在各数据库里的别名

CELESTOLIDE; 13171-00-1; 4-Acetyl-6-tert-butyl-1,1-dimethylindane; FEMA No. 3653; DTXSID9044536; Ethanone, 1-[6-(1,1-dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-inden-4-yl]-; acetyl tert-butyl dimethylindan; 4-Acetyl-6-butyl-1,1-dimethylindane; 6-tert-Butyl-1,1-dimethyl-4-indanyl methyl ketone; Ketone, 6-tert-butyl-1,1-dimethyl-4-indanyl methyl; E1HM68Q21P; DTXCID7024536; 1-(6-tert-butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)ethan-1-one; Ethanone, 1-(6-(1,1-dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-inden-4-yl)-; 1-(6-(1,1-Dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-inden-4-yl)ethanone; RefChem:124289

计算机算出的分子描述符

分子量244.37
XLogP35
氢键供体数0
氢键受体数1
可旋转键数2
精确质量244.182715385
单同位素质量244.182715385
拓扑极性表面积17.1
重原子数18
形式电荷0

数据库摘要

4-Acetyl-6-t-butyl-1,1-dimethylindane is identified by CAS 13171-00-1, molecular formula C17H24O and molecular weight 244.18 g/mol. UNII E1HM68Q21P; ChEBI 172483; InChIKey IKTHMQYJOWTSJO-UHFFFAOYSA-N. 沸点: BP: 304.5 °C at 101.325 kPa; 熔点: 78.5 °C; 熔点: 77.2 - 77.9 °C.

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

获取 4-Acetyl-6-t-butyl-1,1-dimethylindane 报价

供应商:济南圣和化工有限公司 · 一个工作日内回复。

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