Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
Mixture of 2,5-di(propan-2-yl)phenyl diphenyl phosphate and 3,5-di(propan-2-yl)phenyl diphenyl phosphate

Related substances

Identifiers of related substancesopen allclose all
Identifier:
CAS number
Identity:
68937-41-7
Identifier:
CAS number
Identity:
113765-39-2

Molecular and structural information

Molecular formula:
C24H27O4P
Molecular weight:
410.443
SMILES notation:
Variable, dependant on isomer:

2,5 derivative: C1C=C(C=CC=1)OP(OC(=CC=C1)C=C1)(OC(C=C1C(C)C)=C(C=C1)C(C)C)=O
3,5 derivative: C1=CC=C(C=C1)OP(OC(C=C(C1)C(C)C)=CC=1C(C)C)(OC(C=CC1)=CC=1)=O
InChl:
Variable, dependant on isomer:

2,5 derivative: InChI=1S/C24H27O4P/c1-18(2)20-15-16-23(19(3)4)24(17-20)28-29(25,26-21-11-7-5-8-12-21)27-22-13-9-6-10-14-22/h5-19H,1-4H3
3,5 derivative: InChI=1S/C24H27O4P/c1-18(2)20-15-21(19(3)4)17-24(16-20)28-29(25,26-22-11-7-5-8-12-22)27-23-13-9-6-10-14-23/h5-19H,1-4H3
Structural formula:
Chemical structure