4-(Acryloyloxy)benzophenone

C₁₆H₁₂O₃CAS 22535-49-5252.27 g/mol

Open in Covalent MOL file

Alkene Ester Ketone

Properties

Molecular formula: C₁₆H₁₂O₃
Molar mass: 252.27 g/mol
Exact mass: 252.0786 Da
Melting point: 48.5 °C
logP: 3.01Crippen estimate
Polar surface area: 43.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 4

Hazards

Warning

H317 May cause an allergic skin reaction100% of notifiers
H319 Causes serious eye irritation50% of notifiers
H400 Very toxic to aquatic life100% of notifiers
H410 Very toxic to aquatic life with long lasting effects100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264+P265, P272, P273, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, P391, P501

Identifiers

CAS number

22535-49-5

SMILES

C=CC(=O)Oc1ccc(C(=O)c2ccccc2)cc1

InChIKey

LTYBJDPMCPTGEE-UHFFFAOYSA-N

InChI

InChI=1S/C16H12O3/c1-2-15(17)19-14-10-8-13(9-11-14)16(18)12-6-4-3-5-7-12/h2-11H,1H2

Weigh it out

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

Names and synonyms

7 names

2-Propenoic acid, 4-benzoylphenyl ester
Acrylic acid, ester with 4-hydroxybenzophenone
Benzophenone, 4-hydroxy-, acrylate
p-Acryloxybenzophenone
4-Acryloxybenzophenone
4-Benzoylphenyl acrylate
4-Acryloylbenzophenone

Work with 4-(Acryloyloxy)benzophenone

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

4-Phenoxybenzophenone6317-73-354 % similar 1,4-Dibenzoylbenzene3016-97-552 % similar 4,4'-Diphenoxybenzophenone14984-21-551 % similar 4-Methoxybenzophenone611-94-951 % similar Benzophenone119-61-948 % similar 2-(4-Benzoyl-3-hydroxyphenoxy)ethyl acrylate16432-81-848 % similar 4-Benzyloxybenzophenone54589-41-248 % similar 4-[4-[(1-Oxo-2-propenyl)oxy]butoxy]benzoic acid [1,1'-biphenyl]-4-yl ester245760-39-846 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

7-Methoxyflavone22395-22-8 6-Methoxyflavone26964-24-9 5-Methoxyflavone42079-78-7

Elsewhere

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