Compound C31H46O2

2-methyl-3-(3,7,11,15-tetramethylhexadec-2-enyl)naphthalene-1,4-dione

CAS: 81818-54-4

Molecular Formula	`C31H46O2`
Molecular Weight	450.7 g/mol
LogP	10.9
Topological Polar Surface Area	34.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	14
Exact Mass	450.3498
Heavy Atoms	33
Complexity	696.0

Chemical Identifiers

CAS Number	81818-54-4
SMILES	`CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C`
InChIKey	`MBWXNTAXLNYFJB-UHFFFAOYSA-N`

📖 Product Overview

Compound C31H46O2 (CAS: 81818-54-4) is a chemical compound with molecular formula C31H46O2 and molecular weight 450.7 g/mol. Its IUPAC systematic name is 2-methyl-3-(3,7,11,15-tetramethylhexadec-2-enyl)naphthalene-1,4-dione. LogP 10.9 Topological Polar Surface Area 34.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 14 Exact Mass 450.3498 Heavy Atoms 33 Complexity 696.0 InChI Key: MBWXNTAXLNYFJB-UHFFFAOYSA-N. SMILES: CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C.

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