CC1C(OC(=O)O1)C
CAS: 4437-70-1
Name: 4,5-dimethyl-1,3-dioxolan-2-one
SMILES: CC1C(OC(=O)O1)C

Molecular Processing

Molecular formula
C5H8O3
Molecular weight
116.12
Exact mass
116.0473
XLogP
0.93
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
26.49

Supplementary Information

InChIKey: LWLOKSXSAUHTJO-UHFFFAOYSA-N
Synonyme
RefChem:1092850Npc2006924,5-Dimethyl-1,3-dioxolan-2-one4437-70-1Carbonic acid 2,3-butanediyl2,3-butylene carbonateMFCD00060135trans-4,5-dimethyl-1,3-dioxolan-2-one65941-76-6Carbonic acid, cyclic 1,2-dimethylethylene ester1,3-Dioxolan-2-one, 4,5-dimethyl-SCHEMBL137875SCHEMBL2534551,2-Dimethylethylene carbonate2,3-Butanediol cyclic carbonate4,5-Dimethyl-1,3-dioxolan-2-one #AS-83014SY422469E77694EN300-7605151F825402
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