COP(=O)(O)C(C)(C)C(=O)[O-]
Name: 2-[hydroxy(methoxy)phosphoryl]-2-methylpropanoate
SMILES: COP(=O)(O)C(C)(C)C(=O)[O-]

Molecular Processing

Molecular formula
C5H10O5P-
Molecular weight
181.1
Exact mass
181.0271
XLogP
-0.65
TPSA
86.66
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
-1
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
35.92

Supplementary Information

InChIKey: NVNJKIYSHBFHQG-UHFFFAOYSA-M
Synonyme
TRIMETHYLPHOSPHONOACETATEtrimethylphosphonoaceateNVNJKIYSHBFHQG-UHFFFAOYSA-M
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