Return to Results Biotin
CAS Registry Number®
58-85-5
CAS Name
BiotinMolecular Formula
C10H16N2O3SMolecular Mass
244.31Cite this Page
Biotin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=58-85-5 (retrieved ) (CAS RN: 58-85-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
232 °C (decomp)Density (2)
1.42 g/cm³
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
- (2) Traub, W.; Nature (London, United Kingdom), (1956), 178, 649-50, CAplus
Other Names and Identifiers
InChI
InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1
InChIKey
InChIKey=YBJHBAHKTGYVGT-ZKWXMUAHSA-N
SMILES
C(CCCC(O)=O)[C@H]1[C@@]2([C@@](NC(=O)N2)(CS1)[H])[H]
Canonical SMILES
O=C1NC2CSC(CCCCC(=O)O)C2N1
Other Names for this Substance
- 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-
- Biotin
- 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, [3aS-(3aα,4β,6aα)]-
- (3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoic acid
- Bioepiderm
Deleted or Replaced CAS Registry Numbers
3672-05-7, 15720-24-8, 22879-79-4, 58073-87-3
