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4-(Chloromethyl)-2,5-dimethyl-1,3-dioxolane

HCID 178771985
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Basic information

CAS
21590-13-6
Standard SMILES
CC1OC(C)C(CCl)O1
InChIKey
VKNMZZJVJGFDFP-UHFFFAOYSA-N
Molecular formula
C6H11ClO2
Average molar mass
150.6 g/mol

Names & identifiers

Preferred name
4-(Chloromethyl)-2,5-dimethyl-1,3-dioxolane
IUPAC
4-(chloromethyl)-2,5-dimethyl-1,3-dioxolane
English name
1,3-Dioxolane, 4-(chloromethyl)-2,5-dimethyl-, stereoisomer (8CI)
Molecular formula
C6H11ClO2
Molecular weight
150.6

Names & synonyms

4-(chloromethyl)-2,5-dimethyl-1,3-dioxolane1,3-Dioxolane, 4-(chloromethyl)-2,5-dimethyl-1,3-Dioxolane, 4-(chloromethyl)-2,5-dimethyl-, stereoisomer (8CI)

Database identifiers

CAS
21590-13-6

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
97.1

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