6-Benzylpyridin-2-amine

HCID 93902

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Basic information

CAS: 57963-09-4
Standard SMILES: Nc1cccc(Cc2ccccc2)n1
InChIKey: HVYIQDPDESDLFU-UHFFFAOYSA-N
Molecular formula: C12H12N2
Average molar mass: 184.24 g/mol
Monoisotopic mass: 184.10004838

Names & identifiers

Preferred name: 6-Benzylpyridin-2-amine
IUPAC: 6-benzylpyridin-2-amine
English name: 6-benzylpyridin-2-amine
Molecular formula: C12H12N2
Molecular weight: 184.24

Names & synonyms

6-Benzylpyridin-2-amine57963-09-4EINECS 261-040-46-(Phenylmethyl)-2-pyridinamineDTXSID90206695RefChem:540471DTXCID20129186261-040-42-Pyridinamine, 6-(phenylmethyl)-6-Benzyl-2-pyridinamine2-amino-6-benzylpyridineAFP54F5PFB

Show more names

2-PyridinaMine,6-(phenylMethyl)-

SCHEMBL1402167SCHEMBL29758354HCA96309AKOS000278276SB53452DB-072395CS-0246838NS00033823

Database identifiers

CAS: 57963-09-4
PubChem CID: 93902
DTXSID: DTXSID90206695
UNII: AFP54F5PFB
EC Number: 261-040-4
Nikkaji: J296.839H

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 38.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 164

Physicochemical properties

Boiling point: 329.6 · 329.6±27.0 °C(Predicted)
Density: 1.121 · 1.121±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C
pka: 6.48 · 6.48±0.10(Predicted)
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302-H315-H318-H335
Precautionary statements: 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501

Safety & regulation

GHS classification

GHS Classification · 4 items

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: Danger
Symbol(GHS): GHS05,GHS07
Hazard statements: H302-H315-H318-H335
Precautionary statements: P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501