Compound C48H72O3

5-methoxy-2-methyl-3-(3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl)cyclohexa-2,5-diene-1,4-dione

CAS: 6917-54-0

Molecular Formula	`C48H72O3`
Molecular Weight	697.1 g/mol
LogP	15.5
Topological Polar Surface Area	43.4 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	24
Exact Mass	696.54816
Heavy Atoms	51
Complexity	1450.0

Chemical Identifiers

CAS Number	6917-54-0
SMILES	`CC1=C(C(=O)C(=CC1=O)OC)CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C`
InChIKey	`FLYBTLROCQBHMR-UHFFFAOYSA-N`

📖 Product Overview

Compound C48H72O3 (CAS: 6917-54-0) is a chemical compound with molecular formula C48H72O3 and molecular weight 697.1 g/mol. Its IUPAC systematic name is 5-methoxy-2-methyl-3-(3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl)cyclohexa-2,5-diene-1,4-dione. LogP 15.5 Topological Polar Surface Area 43.4 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 24 Exact Mass 696.54816 Heavy Atoms 51 Complexity 1450.0 InChI Key: FLYBTLROCQBHMR-UHFFFAOYSA-N. SMILES: CC1=C(C(=O)C(=CC1=O)OC)CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C.

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