2,3-Dihydroxy-2-methylpropanoic acid

CAT: 0127-OR1056912-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1056912-01Size:250 mg

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CAS Number

21620-60-0

MDL Number

MFCD19228093

Purity

97%

Smiles

O=C(O)C(C)(O)CO

Chemical Information

2-Methylglyceric acid

2,3-dihydroxy-2-methylpropanoic acid is a dihydroxy monocarboxylic acid. It is functionally related to a propionic acid. It is a conjugate acid of a 2,3-dihydroxy-2-methylpropanoate.

CAS Number	21620-60-0
PubChem CID	560781
IUPAC Name	2,3-dihydroxy-2-methylpropanoic acid
Molecular Formula	C4H8O4
Molecular Weight	120.10
XLogP	-1.3
Topological Polar Surface Area	77.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	8
Formal Charge	0
Complexity	100

SMILES

CC(CO)(C(=O)O)O

InChI

InChI=1S/C4H8O4/c1-4(8,2-5)3(6)7/h5,8H,2H2,1H3,(H,6,7)

InChIKey

DGADNPLBVRLJGD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 21620-60-0

CID: 560781

Formula: C4H8O4

MW: 120.10

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	120.10
XLogP3	-1.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	120.04225873
Monoisotopic Mass	120.04225873
Topological Polar Surface Area	77.8 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	100
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
PCA79835-01	2- (3-Chlorophenyl) -2-methylpropanoic acid
413379-01	2- (3-Bromophenyl) -2-methylpropanoic acid
sc-482199	2,3-Dibromo-2-methylpropanoic acid
ZZB65058-01	2,3-Dimethoxy-2-methylpropanoic acid
TDA74820-01	2- (3-Fluorophenyl) -2-methylpropanoic acid
sc-282571	2- (3-methoxyphenoxy) -2-methylpropanoic acid
SAA65394	2- (3-Methoxyphenyl) -2-methylpropanoic acid
PKA87913-01	2- (3-Hydroxyphenyl) -2-methylpropanoic acid
sc-282560	2- (3-chlorophenoxy) -2-methylpropanoic acid
VSA00363-01	2- (3-Cyanophenyl) -2-methylpropanoic acid

2,3-Dihydroxy-2-methylpropanoic acid

Chemical Information

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