CC(=O)OC(CO)CCl
Name: 2-acetyloxy-3-chloropropan-1-ol
SMILES: CC(=O)OC(CO)CCl

Molecular Processing

Molecular formula
C5H9ClO3
Molecular weight
152.58
Exact mass
152.024
XLogP
0.15
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
33.36

Supplementary Information

Details werden geladen…

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