Propanoic acid, 2-hydroxy-2-methyl-, methyl ester


Chemical Name: Propanoic acid, 2-hydroxy-2-methyl-, methyl ester
CAS Number: 2110-78-3
Product Number: AG002L48(AGN-PC-0JLP2Z)
Synonyms:
MDL No:
Molecular Formula: C5H10O3
Molecular Weight: 118.1311

Identification/Properties


Computed Properties
Molecular Weight:
118.132g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
118.063g/mol
Monoisotopic Mass:
118.063g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
95.8
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3272
Hazard Statements:
H226-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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