Ethyl 2-cyano-3,3-diphenylacrylate

C₁₈H₁₅NO₂CAS 5232-99-5277.32 g/mol

Open in Covalent MOL file

Alkene Ester Nitrile

Properties

Molecular formula: C₁₈H₁₅NO₂
Molar mass: 277.32 g/mol
Exact mass: 277.1103 Da
Melting point: 95–97 °C
Boiling point: 175–182 °C (at 1 Torr)
logP: 3.58Crippen estimate
Polar surface area: 50.1 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 4

Hazards

Warning

H315 Causes skin irritation18.7% of notifiers
H319 Causes serious eye irritation18.7% of notifiers
H335 May cause respiratory irritation17.8% of notifiers
H400 Very toxic to aquatic life17.8% of notifiers
H410 Very toxic to aquatic life with long lasting effects20.1% of notifiers

Aggregated from 214 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

5232-99-5

SMILES

CCOC(=O)C(C#N)=C(c1ccccc1)c1ccccc1

InChIKey

IAJNXBNRYMEYAZ-UHFFFAOYSA-N

InChI

InChI=1S/C18H15NO2/c1-2-21-18(20)16(13-19)17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2H2,1H3

Weigh it out

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

Names and synonyms

21 names · show all

2-Propenoic acid, 2-cyano-3,3-diphenyl-, ethyl ester
Acrylic acid, 2-cyano-3,3-diphenyl-, ethyl ester
Uvinul N 35
Ethyl α-cyano-β,β-diphenylacrylate
CE 2
UV Absorber 2
Etocrylene
Ethyl α-cyano-β-phenylcinnamate
CE 2 (ultraviolet absorber)
Ethyl 2-cyano-3,3-diphenyl-2-propenoate
Etocrilene
Viosorb 910
2-Cyano-3-phenylcinnamic acid ethyl ester
Uvinul 3035
Seesorb 501
Ethyl 2-cyano-3,3-diphenylpropenoate
NSC 52678
2-Cyano-3,3-diphenyl-2-propenoic acid ethyl ester
N 35
UV 335
UV 3035

Work with Ethyl 2-cyano-3,3-diphenylacrylate

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

1,3-Bis[(2-cyano-3,3-diphenylacryloyl)oxy]-2,2-bis[[(2-cyano-3,3-diphenylacryloyl)oxy]methyl]propane178671-58-469 % similar Octocrylene6197-30-460 % similar Ethyl benzoylformate1603-79-858 % similar Ethyl benzoate93-89-050 % similar Ethyl 3-cyano-3-phenylpyruvate6362-63-648 % similar Diethyl benzylidenemalonate5292-53-548 % similar Ethyl cyanoacrylate7085-85-048 % similar Ethyl oxanilate1457-85-847 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Hydroxy-N-(2-methylphenyl)-2-naphthalenecarboxamide135-61-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook