1-decylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol

CAS: 102244-23-5

Molecular Formula	`C20H36OS`
Molecular Weight	324.6 g/mol
LogP	7.4
Topological Polar Surface Area	45.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	14
Exact Mass	324.2487
Heavy Atoms	22
Complexity	362.0

Chemical Identifiers

CAS Number	102244-23-5
SMILES	`CCCCCCCCCCSCC(C)C(C)(C#CC(=C)C)O`
InChIKey	`HBTWZHREWLKKRH-UHFFFAOYSA-N`

📖 Product Overview

1-decylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol (CAS: 102244-23-5) is a chemical compound with molecular formula C20H36OS and molecular weight 324.6 g/mol. Its IUPAC systematic name is 1-decylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol. LogP 7.4 Topological Polar Surface Area 45.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 14 Exact Mass 324.2487 Heavy Atoms 22 Complexity 362.0 InChI Key: HBTWZHREWLKKRH-UHFFFAOYSA-N. SMILES: CCCCCCCCCCSCC(C)C(C)(C#CC(=C)C)O.

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