Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

EC number:
242-128-1
EC name:
2,4,6-tris(1-phenylethyl)phenol
CAS number:
18254-13-2

No inventory information available

Reference substance information

IUPAC name:
2,4,6-tris(1-phenylethyl)phenol
Synonyms
Names:
2,4,6-tris(1-phenylethyl)phenol
Phenol, 2,4,6-tris(1-phenylethyl)-
Identifier:
IUPAC name
2,4,6-tris(1-phenylethyl)phenol
Identifier:
IUPAC name
2,4,6-tris(1-phenylethyl)phenol
Identifier:
other: InChl
1S/C30H30O/c1-21(24-13-7-4-8-14-24)27-19-28(22(2)25-15-9-5-10-16-25)30(31)29(20-27)23(3)26-17-11-6-12-18-26/h4-23,31H,1-3H3
Identifier:
other: SMILES notation
CC(C1=C(O)C(C(C)C2=CC=CC=C2)=CC(C(C3=CC=CC=C3)C)=C1)C4=CC=CC=C4
Identifier:
other: SMILES notation
CC(C1=CC=CC=C1)C1=CC(C(C)C2=CC=CC=C2)=C(O)C(=C1)C(C)C1=CC=CC=C1
Identifier:
other: InChl
InChI=1S/C30H30O/c1-21(24-13-7-4-8-14-24)27-19-28(22(2)25-15-9-5-10-16-25)30(31)29(20-27)23(3)26-17-11-6-12-18-26/h4-23,31H,1-3H3
Identifier:
other: SMILES notation
Oc(c(cc(c1)C(c(cccc2)c2)C)C(c(cccc3)c3)C)c1C(c(cccc4)c4)C
Identifier:
other: SMILES notation
Oc1c(cc(cc1[C@@H](c1ccccc1)C)[C@@H](c1ccccc1)C)[C@@H](c1ccccc1)C

CAS information

CAS number:
18254-13-2

Molecular and structural information

Molecular formula:
C30H30O
Molecular weight:
406.559
SMILES notation:
CC(c1ccccc1)c2cc(C(C)c3ccccc3)c(O)c(c2)C(C)c4ccccc4
InChl:
InChI=1/C30H30O/c1-21(24-13-7-4-8-14-24)27-19-28(22(2)25-15-9-5-10-16-25)30(31)29(20-27)23(3)26-17-11-6-12-18-26/h4-23,31H,1-3H3
Structural formula:
Chemical structure