Benzyl(2-methoxyethyl)amine

HCID 2396989

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Basic information

CAS: 51353-26-5
Standard SMILES: COCCNCc1ccccc1
InChIKey: BHKFRWOEIYJBLN-UHFFFAOYSA-N
Molecular formula: C10H15NO
Average molar mass: 165.23 g/mol
Monoisotopic mass: 165.1153641

Names & identifiers

Preferred name: Benzyl(2-methoxyethyl)amine
IUPAC: N-benzyl-2-methoxyethanamine
English name: N-Benzyl-N-(2-methoxyethyl)amine
Molecular formula: C10H15NO
Molecular weight: 165.23

Names & synonyms

BENZYL(2-METHOXYETHYL)AMINERefChem:566882878-057-3N-benzyl-2-methoxyethanamine51353-26-5N-benzyl-N-(2-methoxyethyl)amineMFCD01445287N-benzyl-2-methoxyethan-1-amineSMR000152466N-benzyl-2-methoxyethylamineMLS000565316SCHEMBL556793

Show more names

Benzenemethanamine, N-(2-methoxyethyl)-

SCHEMBL1033166SCHEMBL2183492SCHEMBL7582815benzyl-(2-methoxy-ethyl)-amineCHEMBL1454115DTXSID30368488BHKFRWOEIYJBLN-UHFFFAOYSA-NHMS1747O13

Database identifiers

CAS: 51353-26-5
PubChem CID: 2396989
DTXSID: DTXSID30368488
ChEMBL: CHEMBL1454115
EC Number: 878-057-3
Nikkaji: J1.861.976H

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 21.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 5
Heavy atoms: 12
Formal charge: 0
Complexity: 100

Physicochemical properties

Boiling point: 230.8 · 230.8±15.0 °C(Predicted)
Density: 0.969 · 0.969±0.06 g/cm3(Predicted)
pka: 8.54 · 8.54±0.19(Predicted)
Symbol(GHS): 7 · GHS07,GHS05
Signal word: Danger
Hazard statements: 302 · H302-H335-H318-H315
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
HS Code: 2922190090 · 2922190090

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

hs_code: 2922190090
Signal word: Danger
Symbol(GHS): GHS07,GHS05
Hazard statements: H302-H335-H318-H315
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501