Basic information
- CAS
7507-38-2- Standard SMILES
O=C(Nc1ccccc1)OCCCCl- InChIKey
PWYHRNYXPUTOMA-UHFFFAOYSA-N- Molecular formula
- C10H12ClNO2
- Average molar mass
- 213.66 g/mol
- Monoisotopic mass
- 213.0556563
Names & identifiers
- Preferred name
- 3-chloropropyl N-phenylcarbamate
- IUPAC
- 3-chloropropyl N-phenylcarbamate
Names & synonyms
3-chloropropyl N-phenylcarbamate7507-38-2DTXSID80324913RefChem:278638DTXCID902760303-Chloropropyl phenylcarbamateSCHEMBL118007973-Chloropropyl phenylcarbamate #PWYHRNYXPUTOMA-UHFFFAOYSA-NNSC407973NSC-4079731-Propanol, 3-chloro-, phenylcarbamate
Database identifiers
- CAS
7507-38-2- PubChem CID
- 348588
- DTXSID
DTXSID80324913
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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