Basic information
- CAS
91189-07-0- Standard SMILES
CCNCC1CCN(Cc2ccccc2)C1- InChIKey
AMRNWWPARHIDHZ-UHFFFAOYSA-N- Molecular formula
- C14H22N2
- Average molar mass
- 218.34 g/mol
- Monoisotopic mass
- 218.1782987
Names & identifiers
- Preferred name
- (1-Benzyl-pyrrolidin-3-ylmethyl)-ethyl-amine
- IUPAC
- N-[(1-benzylpyrrolidin-3-yl)methyl]ethanamine
- English name
- (1-Benzyl-pyrrolidin-3-ylmethyl)-ethyl-amine
- Molecular formula
- C14H22N2
- Molecular weight
- 218.34
Names & synonyms
91189-07-0(1-BENZYL-PYRROLIDIN-3-YLMETHYL)-ETHYL-AMINEN-[(1-benzylpyrrolidin-3-yl)methyl]ethanaminen-((1-benzylpyrrolidin-3-yl)methyl)ethanamine[(1-benzylpyrrolidin-3-yl)methyl](ethyl)amineSCHEMBL3810288DTXSID20408589AMRNWWPARHIDHZ-UHFFFAOYSA-NRDA18907MFCD06411058AKOS005288000CS-0265044
Show more names
3-Pyrrolidinemethanamine, N-ethyl-1-(phenylmethyl)-
EN300-96155G42639N-ethyl-1-(phenylmethyl)-3-pyrrolidinemethanamineZ992356884
Database identifiers
- CAS
91189-07-0- PubChem CID
- 5127972
- DTXSID
DTXSID20408589
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- Boiling point
- 302 ℃ · 302℃
- Density
- 0.988 · 0.988
- Flash point
- 107 ℃ · 107℃
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江阴安博生物医药有限公司086-010-62176588 · [email protected]
Related reactions
21 records
Compound notes
Loading…