1-Chloro-1-methoxypropane
Basic information
- CAS
5739-14-0- Standard SMILES
CCC(Cl)OC- InChIKey
YROGWJLGNLJNOK-UHFFFAOYSA-N- Molecular formula
- C4H9ClO
- Average molar mass
- 108.57 g/mol
- Monoisotopic mass
- 108.0341926
Names & identifiers
- Preferred name
- 1-Chloro-1-methoxypropane
- IUPAC
- 1-chloro-1-methoxypropane
Names & synonyms
1-chloro-1-methoxypropane5739-14-0DTXSID50545294RefChem:229200DTXCID90496079chloropropanol methyl etherSCHEMBL1558889SCHEMBL15167653
Database identifiers
- CAS
5739-14-0- PubChem CID
- 13625640
- DTXSID
DTXSID50545294- Nikkaji
- J2.258.176G
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 30.7
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Compound notes
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