Benzenemethanamine, 3-iodo-N-propyl-
Basic information
- CAS
90389-95-0- Standard SMILES
CCCNCc1cccc(I)c1- InChIKey
LEPFIZCLEIWUJS-UHFFFAOYSA-N- Molecular formula
- C10H14IN
- Average molar mass
- 275.13 g/mol
- Monoisotopic mass
- 275.0171
Names & identifiers
- Preferred name
- Benzenemethanamine, 3-iodo-N-propyl-
- IUPAC
- N-[(3-iodophenyl)methyl]propan-1-amine
- English name
- N-(3-Iodophenylmethyl)propylamine
- Molecular formula
- C10H14IN
- Molecular weight
- 0
Names & synonyms
90389-95-0Benzenemethanamine, 3-iodo-N-propyl-DTXSID00238124RefChem:324745DTXCID20160615N-(3-Iodobenzyl)propan-1-amineN-[(3-iodophenyl)methyl]propan-1-amineN-(3-IODOPHENYLMETHYL)PROPYLAMINE[(3-IODOPHENYL)METHYL](PROPYL)AMINESCHEMBL2037464CHEMBL1182785A1-19825
Database identifiers
- CAS
90389-95-0- PubChem CID
- 485405
- DTXSID
DTXSID00238124- ChEMBL
CHEMBL1182785
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 116
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Related reactions
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Compound notes
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