4-Amino-3-ethylbenzonitrile
Properties
- Molecular formula
- C9H10N2
- Molar mass
- 146.19 g/mol
- Exact mass
- 146.0844 Da
- logP
- 1.70Crippen estimate
- Polar surface area
- 49.8 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H301 Toxic if swallowed14.3% of notifiers
- H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled14.3% of notifiers
- H302 Harmful if swallowed57.1% of notifiers
- H311 Toxic in contact with skin71.4% of notifiers
- H315 Causes skin irritation14.3% of notifiers
- H319 Causes serious eye irritation14.3% of notifiers
- H331 Toxic if inhaled14.3% of notifiers
- H332 Harmful if inhaled57.1% of notifiers
- H335 May cause respiratory irritation14.3% of notifiers
Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
170230-87-2SMILES
CCC1=C(C=CC(=C1)C#N)NInChIKey
YOHLABDNVQLZIA-UHFFFAOYSA-NInChI
InChI=1S/C9H10N2/c1-2-8-5-7(6-10)3-4-9(8)11/h3-5H,2,11H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 4-Amino-3-ethylbenzonitrile
Similar compounds
3,4-Diaminobenzonitrile17626-40-358 % similar
4-Amino-3-methylbenzonitrile78881-21-756 % similar
4,4′-Methylenebis[2-ethylbenzenamine]19900-65-353 % similar
4-Amino-3-chlorobenzonitrile21803-75-851 % similar
4-Bromo-2-ethylaniline45762-41-251 % similar
4-Amino-3-bromobenzonitrile50397-74-551 % similar
3-Amino-4-methylbenzonitrile60710-80-751 % similar
4-Amino-3-fluorobenzonitrile63069-50-151 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds