Pentylamine, N,N-bis(2-chloroethyl)-
Basic information
- CAS
100792-06-1- Standard SMILES
CCCCCN(CCCl)CCCl- InChIKey
KPPJKQKNRVSYKR-UHFFFAOYSA-N- Molecular formula
- C9H19Cl2N
- Average molar mass
- 212.16 g/mol
- Monoisotopic mass
- 211.089455
Names & identifiers
- Preferred name
- Pentylamine, N,N-bis(2-chloroethyl)-
- IUPAC
- N,N-bis(2-chloroethyl)pentan-1-amine
Names & synonyms
Pentylamine, N,N-bis(2-chloroethyl)-N,N-Bis(2-chloroethyl)pentylamineBRN 17412751-Pentanamine, N,N-bis(2-chloroethyl)-100792-06-1DTXSID501435124-04-00-00675 (Beilstein Handbook Reference)RefChem:368291DTXCID3066003N,N-bis(2-chloroethyl)pentan-1-amine
Database identifiers
- CAS
100792-06-1- PubChem CID
- 418979
- DTXSID
DTXSID50143512- Nikkaji
- J1.378.796D
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 82.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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