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Reference substances

Reference substances

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General information

Inventory

EC number:
228-250-8
EC name:
Octocrilene
CAS number:
6197-30-4

No inventory information available

Reference substance information

IUPAC name:
2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate
Synonyms
Names:
2-Propenoic acid, 2-cyano-3,3-diphenyl-, 2-ethylhexyl ester
Identifier:
CAS number
6197-30-4
Identifier:
common name
octocrilene
Identifier:
other: SMILES notation
C(\c1ccccc1)(c1ccccc1)=C(/C(OC[C@@H](CCCC)CC)=O)C#N
2-ethylhexyl 2-cyano-3,3-diphenylacrylate

CAS information

CAS number:
6197-30-4

Molecular and structural information

Molecular formula:
C24H27NO2
Molecular weight:
361.477
SMILES notation:
CCCCC(CC)COC(=O)C(=C(c1ccccc1)c2ccccc2)C#N
InChl:
InChI=1/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
Structural formula:
Chemical structure