3-Phenoxybenzenamine
Properties
- Molecular formula
- C12H11NO
- Molar mass
- 185.23 g/mol
- Exact mass
- 185.0841 Da
- Melting point
- 37 °C
- Boiling point
- 315 °C
- logP
- 3.06Crippen estimate
- Polar surface area
- 35.3 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin90.9% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled90.9% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
3586-12-7SMILES
Nc1cccc(Oc2ccccc2)c1InChIKey
UCSYVYFGMFODMY-UHFFFAOYSA-NInChI
InChI=1S/C12H11NO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9H,13H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzenamine, 3-phenoxy-
- Aniline, m-phenoxy-
- 3-Phenoxyaniline
- m-Aminophenyl phenyl ether
- 3-Aminodiphenyl ether
- m-Phenoxyaniline
- NSC 57083
- (3-Phenoxyphenyl)amine
- 3-(Phenyloxy)aniline
Work with 3-Phenoxybenzenamine
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
3,3′-Oxydianiline15268-07-286 % similar
3,3′-[1,3-Phenylenebis(oxy)]bis[benzenamine]10526-07-583 % similar
3,4′-Diaminodiphenyl ether2657-87-680 % similar
4,4′-[1,3-Phenylenebis(oxy)]bis[benzenamine]2479-46-165 % similar
1,3-Diphenoxybenzene3379-38-265 % similar
3,3′-[Sulfonylbis(4,1-phenyleneoxy)]bis[benzenamine]30203-11-363 % similar
3-(Benzyloxy)aniline1484-26-058 % similar
M-Anisidine536-90-357 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds