AG003A72

6168-83-8 | (S)-3-Hydroxybutanoic acid

AG003A72

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CAS Number	6168-83-8
Catalog Number	AG003A72(AGN-PC-0ODGL0)
Chemical Name	(S)-3-Hydroxybutanoic acid
EC Number	228-209-4
IUPAC Name	(3S)-3-hydroxybutanoic acid
InChI	InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m0/s1
InChI Key	WHBMMWSBFZVSSR-VKHMYHEASA-N
MDL Number	MFCD00137685
Molecular Formula	C4H8O3
Molecular Weight	104.1045
SMILES	O[C@H](CC(=O)O)C
UNII	VK6OM9M3WP
Synonyms	(S)-3-Hydroxybutyric acid, (S)-3-hydroxybutanoic acid, 6168-83-8, (3S)-3-hydroxybutanoic acid, (S)-3-Hydroxybutanoate, UNII-VK6OM9M3WP, 3-hydroxy-butyrate, L-3-Hydroxybutyric acid, VK6OM9M3WP, (+)-3-Hydroxybutyric acid, (3S)-3-hydroxybutyric acid, L-(+)-3-Hydroxybutyric acid, CHEMBL1162497, CHEBI:17290, Butanoic acid, 3-hydroxy-, (3S)-, (S)-3HB, SMR000857204, beta-Hydroxybutyrate,l, beta-L-hydroxybutyrate, beta-Hydroxybutyrate, L-, beta-L-hydroxybutyric acid, 3-Hydroxybutanoic acid, (S)-, (S)-(+)-3-Hydroxybutyric acid, 3HL, EINECS 228-209-4, L-beta-Hydroxybutyrate, (S)-b-Hydroxyisobutyrate, (S)-3-hydroxy-Butanoate, AC1L3RZ5, AC1Q5T2S, (3S)-3-hydroxy-Butanoate, (S)-beta-Hydroxyisobutyrate, L-(+)-b-Hydroxyisobutyrate, (S)-beta-hydroxybutyric acid, (S)-b-Hydroxyisobutyric acid, MLS001333229, MLS001333230, (S)-3-hydroxy-Butanoic acid, SCHEMBL336331, L-(+)-2-methyl-Hydracrylate, L-(+)-beta-Hydroxyisobutyrate, GTPL4699, (+)-3-hydroxy-n-butyric acid, (3S)-3-hydroxy-Butanoic acid, (S)-beta-hydroxyisobutyric acid, L-(+)-b-Hydroxyisobutyric acid, (S)-3-HYDROXYBUTYRICACID, WHBMMWSBFZVSSR-VKHMYHEASA-N, HMS2231P22, ZINC901665, L-(+)-2-methyl-Hydracrylic acid, L-(+)-beta-hydroxyisobutyric acid, KS-000024PL, (S)-3-hydroxy-2-methyl-Propanoate, BDBM50344957, CH-196, LMFA01050463, MFCD00137685, AKOS006239831, DS-2801, HY-W050031, MP-0594, NCGC00247035-01, (S)-3-Hydroxybutyric acid, >=97.0%, AJ-24374, DB-005558, ST2414634, CS-0031375, FT-0081146, FT-0605325, Z4946, C03197, 168H838, UNII-TZP1275679 component WHBMMWSBFZVSSR-VKHMYHEASA-N, 3-hydroxybutyric acid, (S)-3-hydroxybutyrate, D0YT6O, -3-HYDROXYBUTYRICACID, C4H8O3, Butyric acid, 3-hydroxy-, L-, KST-1A6729, C4-H8-O3, CID94318, FA(4:0(OH)), Butanoic acid, 3-hydroxy-, (S)-, AR-1A4507, (S)-3-HYDROXY-2-METHYL-PROPANOIC ACID, 6290-31-9,

Complexity	69.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	104.047g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	104.105g/mol
Monoisotopic Mass	104.047g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number