(1-Benzyl-4-phenylpiperidin-4-yl)methanamine
Basic information
- CAS
84176-77-2- Standard SMILES
NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1- InChIKey
KNLXJOKXXMNECJ-UHFFFAOYSA-N- Molecular formula
- C19H24N2
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.19394877
Names & identifiers
- Preferred name
- (1-Benzyl-4-phenylpiperidin-4-yl)methanamine
- IUPAC
- (1-benzyl-4-phenylpiperidin-4-yl)methanamine
- English name
- 1-benzyl-4-phenylpiperidine-4-methylamine
- Molecular formula
- C19H24N2
- Molecular weight
- 280.41
Names & synonyms
(1-benzyl-4-phenylpiperidin-4-yl)methanamine84176-77-21-(1-benzyl-4-phenylpiperidin-4-yl)methanamine1-Benzyl-4-phenylpiperidine-4-methylamineMFCD03445314EINECS 282-344-3Cambridge id 70402104-Phenyl-1-(phenylmethyl)-4-piperidinemethanamineSCHEMBL2470240DTXSID60233099JDA17677AKOS016008584
Show more names
4-Piperidinemethanamine, 4-phenyl-1-(phenylmethyl)-1-(1-benzyl-4-phenylpiperidin-4-yl)methanamine(SALTDATA: FREE)
SB44071AS-39477DA-02483(1-benzyl-4-phenyl-4-piperidyl)methanamine4(aminomethyl)-1-benzyl-4-phenylpiperidine1-N-Benzyl-4-phenyl-4-aminomethylpiperidine4-(Aminomethyl)-1-benzyl-4-phenylpiperidineCS-0208407
Database identifiers
- CAS
84176-77-2- PubChem CID
- 804238
- DTXSID
DTXSID60233099- EC Number
- 282-344-3
- Nikkaji
- J333.063J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 295
Physicochemical properties
- Melting point
- 71 · 71-72 °C
- Boiling point
- 224 · 224-226 °C(Press: 1 Torr)
- Density
- 1.065 · 1.065±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.13 · 10.13±0.29(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Suppliers
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Related reactions
12 records
Compound notes
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