1-Chloro-3-(nonyloxy)propan-2-OL
Basic information
- CAS
80938-29-0- Standard SMILES
CCCCCCCCCOCC(O)CCl- InChIKey
LJRMNOFHEXXZKN-UHFFFAOYSA-N- Molecular formula
- C12H25ClO2
- Average molar mass
- 236.78 g/mol
- Monoisotopic mass
- 236.1543077
Names & identifiers
- Preferred name
- 1-Chloro-3-(nonyloxy)propan-2-OL
- IUPAC
- 1-chloro-3-nonoxypropan-2-ol
Names & synonyms
80938-29-0NSC2916411-CHLORO-3-(NONYLOXY)PROPAN-2-OLDTXSID00315060NSC-291641
Database identifiers
- CAS
80938-29-0- PubChem CID
- 324852
- DTXSID
DTXSID00315060
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 120
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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