N-Methylbenzylamine

C₈H₁₁NCAS 103-67-3121.18 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₈H₁₁N
Molar mass: 121.18 g/mol
Exact mass: 121.0891 Da
Melting point: 59.6 °C
Boiling point: 180.5 °C
logP: 1.41Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

Danger

H226 Flammable liquid and vapor93.6% of notifiers
H302 Harmful if swallowed97.3% of notifiers
H312 Harmful in contact with skin93.7% of notifiers
H314 Causes severe skin burns and eye damage99.7% of notifiers
H332 Harmful if inhaled93.6% of notifiers
H412 Harmful to aquatic life with long lasting effects93.6% of notifiers

Aggregated from 2,144 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

103-67-3

SMILES

CNCc1ccccc1

InChIKey

RIWRFSMVIUAEBX-UHFFFAOYSA-N

InChI

InChI=1S/C8H11N/c1-9-7-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names

Benzenemethanamine, N-methyl-
Benzylamine, N-methyl-
N-Methylbenzenemethanamine
N-Benzylmethylamine
Benzylmethylamine
N-Benzyl-N-methylamine
N-(Phenylmethyl)methylamine
N-Methyl-N-benzylamine
N-Methyl-N-(phenylmethyl)amine
NSC 8059
N-Methyl-1-phenylmethanamine
N-Benzylmethanamine

Work with N-Methylbenzylamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methylphenethylamine589-08-261 % similar N-Methyl-4-pyridinemethanamine6971-44-458 % similar Dibenzylamine103-49-157 % similar 4-Chloro-N-methylbenzenemethanamine104-11-056 % similar 4-Amino-N-methylbenzenemethanamine38020-69-856 % similar 4-Fluoro-N-methylbenzenemethanamine405-66-356 % similar (4-Bromobenzyl)methylamine699-03-656 % similar N-Methyl-3-pyridinemethanamine20173-04-056 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Methylbenzylamine100-81-2 N-Ethylaniline103-69-5 4-Methylbenzylamine104-84-7 5-Ethyl-2-methylpyridine104-90-5 3,5-Xylidine108-69-0 2,4,6-Trimethylpyridine108-75-8 4-Propylpyridine1122-81-2 Dimethylaniline121-69-7

Elsewhere

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