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Structure

Methyl(S)-(+)-3-hydroxy-2-methylpropionate

CAS
80657-57-4
Catalog Number
ACM80657574
Category
Other Products
Molecular Weight
118.13g/mol
Molecular Formula
C5H10O3

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Specification

IUPAC Name
methyl (2S)-3-hydroxy-2-methylpropanoate
Canonical SMILES
CC(CO)C(=O)OC
InChI
InChI=1S/C5H10O3/c1-4(3-6)5(7)8-2/h4,6H,3H2,1-2H3/t4-/m0/s1
InChI Key
ATCCIZURPPEVIZ-BYPYZUCNSA-N
Complexity
79.7
Covalently-Bonded Unit Count
1
Exact Mass
118.062994g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
8
Monoisotopic Mass
118.062994g/mol
Rotatable Bond Count
3
XLogP3
-0.1
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