5-Hepten-2-one, 6-methyl-3-(3-methyl-2-butenyl)-

6-methyl-3-(3-methylbut-2-enyl)hept-5-en-2-one

CAS: 2753-03-9

Molecular Formula	`C13H22O`
Molecular Weight	194.31 g/mol
LogP	3.8
Topological Polar Surface Area	17.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	1
Rotatable Bonds	5
Exact Mass	194.16707
Heavy Atoms	14
Complexity	218.0

Chemical Identifiers

CAS Number	2753-03-9
SMILES	`CC(=CCC(CC=C(C)C)C(=O)C)C`
InChIKey	`XQRBPMRCHFTCNL-UHFFFAOYSA-N`

📖 Product Overview

5-Hepten-2-one, 6-methyl-3-(3-methyl-2-butenyl)- (CAS: 2753-03-9) is a chemical compound with molecular formula C13H22O and molecular weight 194.31 g/mol. Its IUPAC systematic name is 6-methyl-3-(3-methylbut-2-enyl)hept-5-en-2-one. LogP 3.8 Topological Polar Surface Area 17.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 1 Rotatable Bonds 5 Exact Mass 194.16707 Heavy Atoms 14 Complexity 218.0 InChI Key: XQRBPMRCHFTCNL-UHFFFAOYSA-N. SMILES: CC(=CCC(CC=C(C)C)C(=O)C)C.

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