3-Aminobenzophenone

C₁₃H₁₁NOCAS 2835-78-1197.24 g/mol

Open in Covalent MOL file

Ketone Primary amine

Properties

Molecular formula: C₁₃H₁₁NO
Molar mass: 197.24 g/mol
Exact mass: 197.0841 Da
Melting point: 86 °C
logP: 2.50Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation97.9% of notifiers
H319 Causes serious eye irritation97.9% of notifiers
H335 May cause respiratory irritation12.8% of notifiers

Aggregated from 47 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

2835-78-1

SMILES

Nc1cccc(C(=O)c2ccccc2)c1

InChIKey

FUADXEJBHCKVBN-UHFFFAOYSA-N

InChI

InChI=1S/C13H11NO/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9H,14H2

Weigh it out

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

Names and synonyms

7 names

Methanone, (3-aminophenyl)phenyl-
Benzophenone, 3-amino-
(3-Aminophenyl)phenylmethanone
m-Aminobenzophenone
3-Benzoylaniline
NSC 86511
3-Phenylcarbonylaniline

Work with 3-Aminobenzophenone

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3,3'-Diaminobenzophenone611-79-088 % similar 1,3-Dibenzoylbenzene3770-82-969 % similar Benzophenone119-61-960 % similar 3,4-Diaminobenzophenone39070-63-859 % similar 1,3,5-Tribenzoylbenzene25871-69-659 % similar 3-Bromobenzophenone1016-77-958 % similar 3-Chlorobenzophenone1016-78-058 % similar 3-Fluorobenzophenone345-69-758 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Aminobenzophenone1137-41-3 (7-Methoxynaphthalen-1-yl)acetonitrile138113-08-3 1,2,6,7-Tetrahydro-8H-indeno-(5,4-B)-furan-8-ylidene acetonitrile196597-79-2 2-Aminobenzophenone2835-77-0 4-Phenylbenzamide3815-20-1 (R)-(-)-1-(1-Naphthyl)ethyl isocyanate42340-98-7 Diphenyl ketoxime574-66-3 Diphenylformamide607-00-1

Elsewhere

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