2-Methylbenzylamine
Properties
- Molecular formula
- C8H11N
- Molar mass
- 121.18 g/mol
- Exact mass
- 121.0891 Da
- Melting point
- −30 °C
- Boiling point
- 206 °C
- logP
- 1.45Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H314 Causes severe skin burns and eye damage100% of notifiers
Aggregated from 47 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
89-93-0SMILES
Cc1ccccc1CNInChIKey
CJAAPVQEZPAQNI-UHFFFAOYSA-NInChI
InChI=1S/C8H11N/c1-7-4-2-3-5-8(7)6-9/h2-5H,6,9H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzenemethanamine, 2-methyl-
- Benzylamine, o-methyl-
- 2-Methylbenzenemethanamine
- o-Methylbenzylamine
- o-Xylylamine
- ((2-Methylphenyl)methyl)amine
- NSC 30466
- (2-Methylphenyl)methanamine
- o-Tolylmethanamine
Work with 2-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
2,3-Dimethylbenzylamine51586-20-065 % similar
2-Methylphenethylamine55755-16-362 % similar
1-Ethyl-2-methylbenzene611-14-356 % similar
2-Methylbenzyl chloride552-45-454 % similar
2-Methylbenzyl bromide89-92-954 % similar
2-Methylbenzyl alcohol89-95-254 % similar
2,5-Dimethylbenzenemethanamine93-48-154 % similar
2,4-Dimethylbenzenemethanamine94-98-454 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.