HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 22713Generated: October 27, 2026
N-Benzyl-2-chloroethan-1-amine
N-Benzyl-2-chloroethan-1-amine · Revefenacin Impurity 139 · N-Benzyl-2-chloroethylamine · N-Benzyl-N-(2-chloroethyl)amine · N-Benzyl-2-chloroethylamine 90+% · Benzenemethanamine, N-(2-chloroethyl)- · N-(2-Chloroethyl)benzylamine, Benzyl(2-chloroethyl)amine
https://huagongshe.com/en/chemical/22713
Identifiers & Physical Properties
| CAS No. | 42074-16-8 |
|---|
| Molecular formula | C9H12ClN |
|---|
| Average molar mass | 169.65 g/mol |
|---|
| Monoisotopic mass | 169.0658271 g/mol |
|---|
| SMILES | ClCCNCc1ccccc1 |
|---|
| InChIKey | XTXGPBAONFJRNO-UHFFFAOYSA-N |
|---|
| PubChem CID | 22713 |
|---|
| DTXSID | DTXSID70274731 |
|---|
Chemical & Physical Properties
| XLogP | 2.1 |
|---|
| Topological polar surface area | 12 |
|---|
| Hydrogen bond donors | 1 |
|---|
| Hydrogen bond acceptors | 1 |
|---|
| Rotatable bonds | 4 |
|---|
| Heavy atoms | 11 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 89 |
|---|
| Boiling point | 245.1±23.0 °C(Predicted) |
|---|
| Density | 1.067±0.06 g/cm3(Predicted) |
|---|
| pKa (acidity coefficient) | 7.77±0.19(Predicted) |
|---|
| Physical state | crystals |
|---|
| Color | WHITE TO OFF WHITE |
|---|
| GHS pictogram | GHS07 |
|---|
| Signal word | Warning |
|---|
| GHS hazard statements | H302+H312+H332-H315-H319-H335 |
|---|
| GHS precautionary statements | P280 |
|---|
| Customs code | 2921490090 |
|---|
Safety & Regulations
| Customs code | 2921490090 |
|---|
| Signal word | Warning |
|---|
| GHS pictogram | GHS07 |
|---|
| GHS hazard statements | H302+H312+H332-H315-H319-H335 |
|---|
| GHS precautionary statements | P280 |
|---|
