1-Benzoylnaphthalene

C₁₇H₁₂OCAS 642-29-5232.28 g/mol

Open in Covalent MOL file

Ketone

Properties

Molecular formula: C₁₇H₁₂O
Molar mass: 232.28 g/mol
Exact mass: 232.0888 Da
Melting point: 75.5 °C
Boiling point: 225 °C (at 12 Torr)
logP: 4.07Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed16.7% of notifiers
H315 Causes skin irritation83.3% of notifiers
H319 Causes serious eye irritation83.3% of notifiers
H335 May cause respiratory irritation83.3% of notifiers
H411 Toxic to aquatic life with long lasting effects16.7% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

642-29-5

SMILES

O=C(c1ccccc1)c1cccc2ccccc12

InChIKey

CXAYOCVHDCXPAI-UHFFFAOYSA-N

InChI

InChI=1S/C17H12O/c18-17(14-8-2-1-3-9-14)16-12-6-10-13-7-4-5-11-15(13)16/h1-12H

Weigh it out

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

Names and synonyms

10 names

Methanone, 1-naphthalenylphenyl-
Ketone, 1-naphthyl phenyl
1-Naphthalenylphenylmethanone
1-Naphthyl phenyl ketone
α-Naphthyl phenyl ketone
Phenyl 1-naphthyl ketone
α-Benzoylnaphthalene
1-Naphthophenone
(1-Naphthalenyl)phenyl methanone
NSC 6729

Work with 1-Benzoylnaphthalene

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

1,2-Dibenzoylbenzene1159-86-065 % similar 2-Chlorobenzophenone5162-03-858 % similar 1,3-Dibenzoylbenzene3770-82-957 % similar 3-Naphthoylindole109555-87-556 % similar 2-Bromobenzophenone13047-06-855 % similar Benzophenone119-61-954 % similar 1,3,5-Tribenzoylbenzene25871-69-654 % similar 2-Hydroxybenzophenone117-99-753 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Pyrenemethanol24463-15-8 1-Methoxypyrene34246-96-3 3-(9-Anthracenyl)-2-propenal38982-12-6 2-Benzoylnaphthalene644-13-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook