AG002IP6

2068-83-9 | Propanoic acid, 3-hydroxy-2-methyl-

AG002IP6

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CAS Number	2068-83-9
Catalog Number	AG002IP6(AGN-PC-004KV7)
Chemical Name	Propanoic acid, 3-hydroxy-2-methyl-
IUPAC Name	3-hydroxy-2-methylpropanoic acid
InChI	InChI=1S/C4H8O3/c1-3(2-5)4(6)7/h3,5H,2H2,1H3,(H,6,7)
InChI Key	DBXBTMSZEOQQDU-UHFFFAOYSA-N
MDL Number	MFCD11975300
Molecular Formula	C4H8O3
Molecular Weight	104.1045
SMILES	CC(C(=O)O)CO
Synonyms	3-hydroxyisobutyric acid, 3-hydroxyisobutyric acid, (R)-isomer, 3-Hydroxyisobutyric acid, 3-Hydroxy-2-methylpropanoic acid, 2068-83-9, rac 3-Hydroxyisobutyric Acid, propanoic acid, 3-hydroxy-2-methyl-, 3-hydroxy-2-isobutyrate, 3-Hydroxyisobutyrate, AC1Q5RQW, beta-hydroxyisobutyric acid, SCHEMBL61073, 3-Hydroxy-2-isobutyric acid, AC1L18G7, AC1Q2B37, CHEBI:18064, CTK1A2390, (R)-2-Hydroxymethylpropanoicacid, 3-hydroxy-2-methylpropionic acid, DBXBTMSZEOQQDU-UHFFFAOYSA-N, 3-hydroxy-2-methyl-propanoic acid, MFCD11975300, AKOS008135403, MCULE-2772009804, AN-50087, BS-12723, HY-113126, CS-0059643, FT-0669691, EN300-55072, C01188, 23043-EP2314591A1, J-013525, Acetonate, HIBA, a-hydroxyisobutyric acid, 3-Hydroxy-2-methylpropanoate, (S)-3-hydroxyisobutyric acid, UNII-K75C8JDF5W, CID87, K75C8JDF5W, 3-hydroxy-2-methylpropionate, 3-hydroxy-2-methylpropanoicacid, 2-Methyl-3-hydroxypropanoic Acid, (R)-3-hydroxy-2-methylpropanoic acid, Propanoicacid,3-hydroxy-2-methyl-, AR-1H6690, (S)-3-hydroxy-2-methylpropanoic acid, (2r)-3-Hydroxy-2-Methylpropanoic Acid, A4216, 1910-47-0, 26543-05-5, 58337-98-7,

Complexity	69.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
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	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

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