AG00I9MC

Name: D-Biotinol
Brand: Angene Chemical
SKU: AG00I9MC

53906-36-8 | D-Biotinol

AG00I9MC

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CAS Number	53906-36-8
Catalog Number	AG00I9MC(AGN-PC-0SG5GR)
Chemical Name	D-Biotinol
IUPAC Name	(3aS,4S,6aR)-4-(5-hydroxypentyl)-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-2-one
InChI	InChI=1S/C10H18N2O2S/c13-5-3-1-2-4-8-9-7(6-15-8)11-10(14)12-9/h7-9,13H,1-6H2,(H2,11,12,14)/t7-,8-,9-/m0/s1
InChI Key	RGIKRHKHRAAZIO-CIUDSAMLSA-N
MDL Number	MFCD30532025
Molecular Formula	C10H18N2O2S
Molecular Weight	230.3271
SMILES	C(CCCCO)[C@H]1[C@@H]2[C@H](CS1)NC(=O)N2
Synonyms	D-Biotinol, CHEMBL2063398, biotinol, 53906-36-8, SCHEMBL6892316, BDBM50388927, MFCD30532025, (3abeta,6abeta)-4alpha-(5-Hydroxypentyl)hexahydro-1H-thieno[3,4-d]imidazole-2-one, CID10082587, (1S,2S,5S)-2-(5-hydroxypentyl)-3-thia-6,8-diazabicyclo[3.3.0]octan-7-one,

Complexity	238
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	230.109g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	230.326g/mol
Monoisotopic Mass	230.109g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	86.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited