(Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene

C11H20S — CID 88884473

IUPAC(Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene
SMILESC=C(S/C(=C\C)C(C)C)C(C)C
InChIInChI=1S/C11H20S/c1-7-11(9(4)5)12-10(6)8(2)3/h7-9H,6H2,1-5H3/b11-7-
InChIKeyDHIITUBHLJBJNA-XFFZJAGNSA-N
MW184.35 g/mol
LogP4.45
Rot. Bonds4

About (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene

(Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene (PubChem CID 88884473) has the molecular formula C11H20S and a molecular weight of 184.35 g/mol. Its IUPAC name is (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene.

Molecular Properties

Compound Name(Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene
PubChem CID88884473
Molecular FormulaC11H20S
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name(Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene
SMILESC=C(S/C(=C\C)C(C)C)C(C)C
InChIInChI=1S/C11H20S/c1-7-11(9(4)5)12-10(6)8(2)3/h7-9H,6H2,1-5H3/b11-7-
InChIKeyDHIITUBHLJBJNA-XFFZJAGNSA-N
XLogP4.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene?
The IUPAC name of (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene (CID 88884473) is (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene.
What is the SMILES notation for (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene?
The canonical SMILES for (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene is C=C(S/C(=C\C)C(C)C)C(C)C.
What is the InChIKey of (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene?
The InChIKey is DHIITUBHLJBJNA-XFFZJAGNSA-N. The full InChI is InChI=1S/C11H20S/c1-7-11(9(4)5)12-10(6)8(2)3/h7-9H,6H2,1-5H3/b11-7-.
What are the key properties of (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene?
(Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene has a molecular weight of 184.35 g/mol, XLogP of 4.45, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methyl-3-(3-methylbut-1-en-2-ylsulfanyl)pent-2-ene is sourced from PubChem (CID 88884473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).