d-Biotin (CAS 58-85-5) — formula C10H16N2O3S, molecular weight 244.31.
d-Biotin is a chemical compound with CAS registry number 58-85-5 and molecular formula C10H16N2O3S (molecular weight 244.31).
CAS number: 58-85-5
Its molecular formula C10H16N2O3S comprises 10 C, 16 H, 2 N, 3 O, 1 S atoms.
Also known as: d-Biotin · Vitamin H · Biotin
The CAS registry number of d-Biotin is 58-85-5.
Molecular formula C10H16N2O3S, molecular weight 244.31.
It is also registered under: d-Biotin, Vitamin H, Biotin.
Public-database records for d-Biotin (CAS 58-85-5), reproduced here for independent cross-checking.
| GHS 通报统计 | 99.6% (265 / 266) |
|---|
| 法规与食品接触 | FDA Substance added to food: NUTRIENT SUPPLEMENT, SEQUESTRANT CIR / INCI: Cosmetic ingredients (Biotin) -> CIR (Cosmetic Ingredient Review) CIR / INCI: Hair conditioning; Skin conditioning; Antiseborrhoeic |
|---|---|
| GHS 通报统计 | 99.6% (265 / 266) |
| 熔点 | 232 |
|---|---|
| 熔点 | 232 °C (decomposes) |
| 熔点 | 232 °C |
| 溶解度 | 220 |
| 溶解度 | 0.22 mg/mL at 25 °C |
| 蒸气压 | 0.00000001 [mmHg] |
| LogP | 0.5 |
| LogP | 0.39 |
| Collision Cross Section | 151.4 Ų [M+H]+ |
| Collision Cross Section | 157.1 Ų [M-H]- |
| CAS 号 | 58-85-5 |
|---|---|
| PubChem CID | 171548 |
| 分子式 | C10H16N2O3S |
| 分子量 | 244.09 g/mol |
| IUPAC 名称 | 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid |
| InChIKey | YBJHBAHKTGYVGT-ZKWXMUAHSA-N |
| UNII(FDA) | 6SO6U10H04 |
| ChEBI 编号 | CHEBI:15956 |
| ATC 编码(WHO) | A11HA05 |
biotin; d-biotin; 58-85-5; vitamin H; Vitamin B7; Bioepiderm; coenzyme R; Factor S; Bios II; D(+)-Biotin; D-(+)-Biotin; (+)-Biotin; Biotine; Biotina; Factor S (vitamin); Injacom H
| 分子量 | 244.31 |
|---|---|
| XLogP3 | 0.3 |
| 氢键供体数 | 3 |
| 氢键受体数 | 4 |
| 可旋转键数 | 5 |
| 精确质量 | 244.08816355 |
| 单同位素质量 | 244.08816355 |
| 拓扑极性表面积 | 104 |
| 重原子数 | 16 |
| 形式电荷 | 0 |
维生素H 的 CAS 号为 58-85-5,分子式 C10H16N2O3S,分子量 244.09 g/mol。 UNII 6SO6U10H04; ChEBI 15956; InChIKey YBJHBAHKTGYVGT-ZKWXMUAHSA-N. 熔点: 232; 熔点: 232 °C (decomposes); 熔点: 232 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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