Octocrylene

C₂₄H₂₇NO₂CAS 6197-30-4361.49 g/mol

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Alkene Ester Nitrile

Properties

Molecular formula: C₂₄H₂₇NO₂
Molar mass: 361.49 g/mol
Exact mass: 361.2042 Da
Water solubility: insoluble
logP: 5.77Crippen estimate
Polar surface area: 50.1 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 9

Hazards

Warning

H410 Very toxic to aquatic life with long lasting effects42.6% of notifiers
H413 May cause long lasting harmful effects to aquatic life51.2% of notifiers

Aggregated from 645 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P391, P501

Identifiers

CAS number

6197-30-4

SMILES

CCCCC(CC)COC(=O)C(C#N)=C(c1ccccc1)c1ccccc1

InChIKey

FMJSMJQBSVNSBF-UHFFFAOYSA-N

InChI

InChI=1S/C24H27NO2/c1-3-5-12-19(4-2)18-27-24(26)22(17-25)23(20-13-8-6-9-14-20)21-15-10-7-11-16-21/h6-11,13-16,19H,3-5,12,18H2,1-2H3

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Names and synonyms

26 names · show all

2-Propenoic acid, 2-cyano-3,3-diphenyl-, 2-ethylhexyl ester
Acrylic acid, 2-cyano-3,3-diphenyl-, 2-ethylhexyl ester
Agent AT 539
Uvinul N 539
2-Ethylhexyl 2-cyano-3,3-diphenylacrylate
2-Ethylhexyl α-cyano-β-phenylcinnamate
2-Ethylhexyl 2-cyano-3,3-diphenyl-2-propenoate
Octocrilene
2′-Ethylhexyl 2-cyano-3-phenylcinnamate
Viosorb 930
2-Ethylhexyl α-cyano-β,β′-diphenylacrylate
Uvinul 3039
Eusolex OCR
Sanduvor 3039
Neo heliopan 303
Uvinul N 539T
Uvinul N 539SG
2-Cyano-3,3-diphenylacrylic acid 2-ethylhexyl ester
CA 1 (light stabilizer)
CA 1
Parsol 340
Seesorb 502
Escalol 597
2-Ethylhexyl-3,3-diphenylcyanoacrylate
N 539
UV 3039

Work with Octocrylene

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

Ethyl 2-cyano-3,3-diphenylacrylate5232-99-560 % similar 1,3-Bis[(2-cyano-3,3-diphenylacryloyl)oxy]-2,2-bis[[(2-cyano-3,3-diphenylacryloyl)oxy]methyl]propane178671-58-457 % similar Bis(2-ethylhexyl) phthalate117-81-753 % similar Bis(2-ethylhexyl) terephthalate6422-86-252 % similar Ethylhexyl methacrylate688-84-649 % similar 2-Ethylhexyl salicylate118-60-547 % similar 2-Ethylhexyl cyanoacetate13361-34-747 % similar Mono(2-ethylhexyl) phthalate4376-20-947 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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