1-(2-Naphthyl)methanamine

HCID 137282CAS 2018-90-8

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Basic information

Standard SMILES: NCc1ccc2ccccc2c1
InChIKey: XBCAHQUVHHVHHL-UHFFFAOYSA-N
Molecular formula: C11H11N
Average molar mass: 157.21 g/mol
Monoisotopic mass: 157.08914935

Names & identifiers

Preferred name: 1-(2-Naphthyl)methanamine
IUPAC: naphthalen-2-ylmethanamine
English name: 1-(2-NAPHTHYL)METHANAMINE
Molecular formula: C11H11N
Molecular weight: 157.21

Names & synonyms

1-(2-NAPHTHYL)METHANAMINERefChem:422566899-666-02018-90-82-Naphthalenemethanaminenaphthalen-2-ylmethanamine2-(Aminomethyl)naphthalene2-naphthylmethanamine2-AminomethylnaphthaleneMFCD01529867Naphthalen-2-methylamine(naphthalen-2-yl)methanamine

Show more names

RARECHEM AL BW 0300Naphthyl methanamine1-(2-phthyl)methamineβ-Naphthalenemethylamine2-AMinoMethyl naphthalenenaphthalen-2-ylmethylamine1-(2-Naphthyl)methanamine, 95%

(naphthalene-2-yl)methylamineC-Naphthalen-2-yl-methylamine2-Aminomethylnapthalene2-naphthalenemethylamineCS-W002778AB01018358-012-naphthylmethylamine1-(NAPHTHALEN-2-YL)METHANAMINE

Database identifiers

CAS: 2018-90-8
PubChem CID: 137282
DTXSID: DTXSID40174012
EC Number: 899-666-0
Nikkaji: J903.647D

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 144

Physicochemical properties

Melting point: 59.5 °C · 59.5°C
Boiling point: 271.88 °C · 271.88°C (rough estimate)
Density: 1.0595 · 1.0595 (rough estimate)
refractive index: 1.6722 · 1.6722 (estimate)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 9.06 · 9.06±0.30(Predicted)
form: solid
color: Yellow
InChI: InChI=1S/C11H11N/c12-8-9-5-6-10-3-1-2-4-11（10）7-9/h1-7H，8,12H2
InChIKey: XBCAHQUVHHHHHHL-UHFFFAOYSA-N
SMILES: C1=CC=C2C=C(C=CC2=C1)CN
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H332-H335
Precautionary statements: 280 · P280-P305+P351+P338-P310
HS Code: 2921490090 · 2921490090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (50%)

Safety data

hs_code: 2921490090
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H332-H335
Precautionary statements: P280-P305+P351+P338-P310

Chemistry & industry

Applications

Uses1-(2-Naphthyl)methanamine can be used as organic synthesis intermediates and pharmaceutical intermediates, mainly used in laboratory research and development and chemical production process.