trans-4-(3-Chlorophenyl)-but-3-enylamine
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
NCC/C=C/c1cccc(Cl)c1- InChIKey
LAEGRGVBZQLWJI-DAFODLJHSA-N- Molecular formula
- C10H12ClN
- Average molar mass
- 181.66 g/mol
- Monoisotopic mass
- 181.0658271
Names & identifiers
- Preferred name
- trans-4-(3-Chlorophenyl)-but-3-enylamine
- IUPAC
- (E)-4-(3-chlorophenyl)but-3-en-1-amine
Names & synonyms
SCHEMBL1569784LAEGRGVBZQLWJI-DAFODLJHSA-Ntrans-4-(3-chlorophenyl)-but-3-enylamine
Database identifiers
- PubChem CID
- 22018476
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 145
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…