Basic information
- CAS
6308-98-1- Standard SMILES
c1ccc(CCNCCc2ccccc2)cc1- InChIKey
ACSAKRLPJQIBFB-UHFFFAOYSA-N- Molecular formula
- C16H19N
- Average molar mass
- 225.33 g/mol
- Monoisotopic mass
- 225.15174961
Names & identifiers
- Preferred name
- 2-Phenyl-N-(2-phenylethyl)ethan-1-amine
- IUPAC
- 2-phenyl-N-(2-phenylethyl)ethanamine
- English name
- N,N-BIS(2-PHENYLETHYL)AMINE HYDROCHLORIDE
- Molecular formula
- C16H19N
- Molecular weight
- 225.33
Names & synonyms
6308-98-1DTXSID809790282-Phenyl-N-(2-phenylethyl)ethan-1-amineRefChem:1064155DTXCID001406332DiphenethylamineBis(2-phenylethyl)amineDiphenethyl-amine2-phenyl-N-(2-phenylethyl)ethanamineBenzeneethanamine, N-(2-phenylethyl)-N,N-bis(2-phenylethyl)amine hydrochlorideN-diphenethylamine
Show more names
N,N-Bis(2-phenylethyl)amineSCHEMBL283735SCHEMBL721250N,N-Bis(2-phenylethyl)amine #NSC41741NSC-41741SBB059796AKOS000115598
Database identifiers
- CAS
6308-98-1- PubChem CID
- 22791
- DTXSID
DTXSID80979028- EC Number
- 809-341-7
- Nikkaji
- J411.689E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 158
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Melting point
- 29 °C · 29°C
- Boiling point
- 356.85 °C · 356.85°C (rough estimate)
- Density
- 1.0256 · 1.0256 (rough estimate)
- refractive index
- 1.555 · 1.5550
- pka
- 9.97 · 9.97±0.19(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers5 total
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
福州福康医药科技有限公司18150835816
常州非凡医药科技有限公司0519-82111935 15195055733 · [email protected]
Related reactions
6 records
Compound notes
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