Basic information
- CAS
146986-69-8- Standard SMILES
CC1(C)OC[C@H](C=CCCl)O1- InChIKey
KYZOEZHRMQLZPD-ZETCQYMHSA-N- Molecular formula
- C8H13ClO2
- Average molar mass
- 176.64 g/mol
Names & identifiers
- Preferred name
- (4S)-4-(3-chloroprop-1-enyl)-2,2-dimethyl-1,3-dioxolane
- IUPAC
- (4S)-4-(3-chloroprop-1-enyl)-2,2-dimethyl-1,3-dioxolane
- English name
- (S)-4,5-Isopropylidene-2-pentenyl chloride
- Molecular formula
- C8H13ClO2
- Molecular weight
- 176.64
Names & synonyms
(S)-4,5-Isopropylidene-2-pentenyl chloride(4S)-4-(3-chloroprop-1-enyl)-2,2-dimethyl-1,3-dioxolane1,3-Dioxolane, 4-(3-chloro-1-propenyl)-2,2-dimethyl-, (S)- (9CI)
Database identifiers
- CAS
146986-69-8
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 154
Chemistry & industry
Suppliers2 total
CIVENTICHEM[email protected]
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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