AG003CDN

21641-92-9 | (S)-2-Hydroxy-3,3-dimethylbutanoic acid

AG003CDN

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CAS Number	21641-92-9
Catalog Number	AG003CDN(AGN-PC-0O7W38)
Chemical Name	(S)-2-Hydroxy-3,3-dimethylbutanoic acid
IUPAC Name	(2S)-2-hydroxy-3,3-dimethylbutanoic acid
InChI	InChI=1S/C6H12O3/c1-6(2,3)4(7)5(8)9/h4,7H,1-3H3,(H,8,9)/t4-/m1/s1
InChI Key	FWVNWTNCNWRCOU-SCSAIBSYSA-N
MDL Number	MFCD00192212
Molecular Formula	C6H12O3
Molecular Weight	132.1577
SMILES	CC(C)(C)[C@H](O)C(O)=O
Synonyms	21641-92-9, (S)-2-hydroxy-3,3-dimethylbutanoic acid, (S)-(-)-2-Hydroxy-3,3-dimethylbutyric acid, (S)-(-)-2-Hydroxy-tert-butylacetic acid, (2S)-2-hydroxy-3,3-dimethylbutanoic acid, Butanoic acid, 2-hydroxy-3,3-dimethyl-, (2S)-, (S)-2-hydroxy-3,3-dimethyl-butyric acid, (2S)-2-hydroxy-3,3-dimethyl-butanoic acid, 851866-86-9, AK135563, SCHEMBL640168, (2S)-2-Hydroxy-3,3-dimethylbutanoic acid homopolymer, CTK4E7393, KS-00000LMP, FWVNWTNCNWRCOU-SCSAIBSYSA-N, 22146-57-2, ZINC4975727, FC0795, FCH964085, MFCD00192212, AKOS016846181, CS-W005786, DS-5093, VC30971, ACM21641929, (s)-2-hydroxy-3,3-dimethylbutyric acid, (s)-3,3-dimethyl-2-hydroxybutyric acid, AJ-52726, AN-27060, BP-12914, OR322312, (S)-2-hydroxy-3,3-dimethyl butyric acid, (S)-2-hydroxy-3,3-dimethyl butanoic acid, AB0062989, AX8048058, DB-013667, ST2414607, TC-172715, FT-0649060, FT-0773053, (2S)-3,3-dimethyl-2-oxidanyl-butanoic acid, X-1519, Butanoic acid,2-hydroxy-3,3-dimethyl-, (2S)-, 866H869, A815568, I04-1417, J-014202, (S)-(-)-2-Hydroxy-3,3-dimethylbutyric acid, 97%, UNII-TS4J3KZN8P component FWVNWTNCNWRCOU-SCSAIBSYSA-N, (R)-TRIMETHYLLACTIC ACID, 2-Hydroxy-3,3-dimethylbutyric acid, CID11097105, (S)-(-)-2-HYDROXY-3,3-DIMETHYLBUTYRICACID,

Complexity	112
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	132.079g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	132.159g/mol
Monoisotopic Mass	132.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number