Basic information
- CAS
30684-05-0- Standard SMILES
Cl.NCCCc1ccccc1- InChIKey
KLEBMSJOJMXVFP-UHFFFAOYSA-N- Molecular formula
- C9H14ClN
- Average molar mass
- 171.67 g/mol
- Monoisotopic mass
- 171.0814771
Names & identifiers
- Preferred name
- Benzenepropanamine, hydrochloride (1:1)
- IUPAC
- 3-phenylpropan-1-amine;hydrochloride
Names & synonyms
30684-05-0Benzenepropanamine, hydrochloridePhenpropylamine hydrochlolrideNSC-21173373SG6SV34IPROPYLAMINE, 3-PHENYL-, HYDROCHLORIDERefChem:1078585Benzenepropanamine, hydrochloride (1:1)3-phenylpropan-1-amine hydrochloride3-Phenylpropylamine, hydrochloride3-phenylpropan-1-amine;hydrochloridebenzenepropanamine hydrochloride
Show more names
3-Phenylpropylammonium chlorideSCHEMBL1551608DTXSID90952928ISOBENZIDRINE HYDROCHLORIDEEBC-06195NSC211733DB-357264EN300-7713266
Database identifiers
- CAS
30684-05-0- PubChem CID
- 458430
- DTXSID
DTXSID90952928- UNII
- 73SG6SV34I
Properties
Computed structural properties
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 74.8
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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