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Dimethylol propionic acid

CAT: 0926-FD02504-01Size: 2 KgDry Ice: NoHazardous: No
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CAT#:0926-FD02504-01Size:2 Kg
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CAS Number
4767-03-7
Synonyms
2,2-Bis (hydroxymethyl) propionic acid; DMPA;3-Hydroxy-2- (hydroxymethyl) -2-methylpropanoic acid
MDL Number
MFCD00004199
Smiles
CC (CO) (CO) C (=O) O
Molecular Formula
C5H10O4
Molecular Weight
134.13 g/mol
Controlled
No

Chemical Information

Dimethylolpropionic acid

2,2-Bis(hydroxymethyl)propionic acid is a 3-hydroxy carboxylic acid.

CAS Number4767-03-7
PubChem CID78501
IUPAC Name3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid
Molecular FormulaC5H10O4
Molecular Weight134.13
XLogP-1.3
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity106
SMILES
CC(CO)(CO)C(=O)O
InChI
InChI=1S/C5H10O4/c1-5(2-6,3-7)4(8)9/h6-7H,2-3H2,1H3,(H,8,9)
InChIKey
PTBDIHRZYDMNKB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dimethylolpropionic acid
CAS: 4767-03-7
CID: 78501
Formula: C5H10O4
MW: 134.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight134.13
XLogP3-1.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass134.05790880
Monoisotopic Mass134.05790880
Topological Polar Surface Area77.8 Ų
Heavy Atom Count9
Formal Charge0
Complexity106
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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