4-Methylbenzylamine

C8H11NCAS 104-84-7121.18 g/mol

Open in Covalent MOL file
NH2
Primary amine

Properties

Molecular formula
C8H11N
Molar mass
121.18 g/mol
Exact mass
121.0891 Da
Density
0.9666 g/mL (at 20 °C)
Melting point
12.5 °C
Boiling point
195 °C
logP
1.45Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
104-84-7
SMILES
Cc1ccc(CN)cc1
InChIKey
HMTSWYPNXFHGEP-UHFFFAOYSA-N
InChI
InChI=1S/C8H11N/c1-7-2-4-8(6-9)5-3-7/h2-5H,6,9H2,1H3

Weigh it out

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

Names and synonyms

11 names
  • Benzenemethanamine, 4-methyl-
  • Benzylamine, p-methyl-
  • 4-Methylbenzenemethanamine
  • p-Methylbenzylamine
  • p-Tolylmethylamine
  • p-Methylbenzenemethanamine
  • 4-Aminomethyltoluene
  • ((4-Methylphenyl)methyl)amine
  • NSC 66562
  • 4-Methylphenylmethanamine
  • p-Tolylmethanamine

Work with 4-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

P-Xylylenediamine539-48-067 % similar 4-Methylphenethylamine3261-62-961 % similar 1,2-Bis(4-methylphenyl)ethane538-39-660 % similar 3,5-Dimethylbenzenemethanamine78710-55-157 % similar 4-Aminobenzylamine4403-71-852 % similar 4-Ethyltoluene622-96-852 % similar 2,5-Dimethylbenzenemethanamine93-48-152 % similar 2,4-Dimethylbenzenemethanamine94-98-452 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Methylbenzylamine100-81-2 N-Methylbenzylamine103-67-3 N-Ethylaniline103-69-5 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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