2-Amino-3,5-dimethylbenzoic acid
Properties
- Molecular formula
- C9H11NO2
- Molar mass
- 165.19 g/mol
- Exact mass
- 165.0790 Da
- logP
- 1.58Crippen estimate
- Polar surface area
- 63.3 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
14438-32-5SMILES
CC1=CC(=C(C(=C1)C(=O)O)N)CInChIKey
GIMYRAQQQBFFFJ-UHFFFAOYSA-NInChI
InChI=1S/C9H11NO2/c1-5-3-6(2)8(10)7(4-5)9(11)12/h3-4H,10H2,1-2H3,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-Amino-3,5-dimethylbenzoic acid
Similar compounds
2-Amino-3-bromo-5-methylbenzoic acid13091-43-567 % similar
2-Amino-5-bromo-3-methylbenzoic acid206548-13-267 % similar
2-Amino-5-chloro-3-methylbenzoic acid20776-67-467 % similar
2-Amino-3-methylbenzoic acid4389-45-158 % similar
2,4,6-Trimethylbenzoic acid480-63-758 % similar
2,5-Dimethylbenzoic acid610-72-057 % similar
2,4-Dimethylbenzoic acid611-01-857 % similar
2-Amino-5-methylbenzoic acid2941-78-854 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.