CAS: 7397-62-8
Name: butyl 2-hydroxyacetate
SMILES:
CCCCOC(=O)COMolecular Processing
Molecular formula
C6H12O3
Molecular weight
132.16
Exact mass
132.0786
XLogP
0.32
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
32.95
Supplementary Information
InChIKey: VFGRALUHHHDIQI-UHFFFAOYSA-N
Synonyme
Butyl glycolatebutyl 2-hydroxyacetate7397-62-8Butyl hydroxyacetateAcetic acid, hydroxy-, butyl estern-butyl glycolateDTXSID6044725UNII-3H5QAS0HZX3H5QAS0HZXGlycolic acid, butyl esterAcetic acid, 2-hydroxy-, butyl esterEINECS 230-991-7BUTOXYCARBONYLMETHANOLAI3-07975DTXCID4024725EC 230-991-7RefChem:122255BUTYL GLYCOLATE [INCI]230-991-7VFGRALUHHHDIQI-UHFFFAOYSA-NButyl glycollateMFCD00042732glycolic acid butyl esterButylglykolathydroxyacetic acid butyl estern-butyl hydroxyacetateButyl hydroxyacetate #SCHEMBL164123SCHEMBL473880SCHEMBL2997589
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