4-methyl-1-methylsulfanylpent-1-ene

C7H14S — CID 13307684

IUPAC4-methyl-1-methylsulfanylpent-1-ene
SMILESCSC=CCC(C)C
InChIInChI=1S/C7H14S/c1-7(2)5-4-6-8-3/h4,6-7H,5H2,1-3H3
InChIKeyGDILMVIZRXYQRR-UHFFFAOYSA-N
MW130.26 g/mol
LogP2.91
Rot. Bonds3

About 4-methyl-1-methylsulfanylpent-1-ene

4-methyl-1-methylsulfanylpent-1-ene (PubChem CID 13307684) has the molecular formula C7H14S and a molecular weight of 130.26 g/mol. Its IUPAC name is 4-methyl-1-methylsulfanylpent-1-ene.

Molecular Properties

Compound Name4-methyl-1-methylsulfanylpent-1-ene
PubChem CID13307684
Molecular FormulaC7H14S
Molecular Weight130.26 g/mol
Exact Mass130.08
IUPAC Name4-methyl-1-methylsulfanylpent-1-ene
SMILESCSC=CCC(C)C
InChIInChI=1S/C7H14S/c1-7(2)5-4-6-8-3/h4,6-7H,5H2,1-3H3
InChIKeyGDILMVIZRXYQRR-UHFFFAOYSA-N
XLogP2.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.26
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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(E)-4-methylpent-1-en-1-ol
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7-methylocta-2,4-diene
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(E)-2,6-dimethylhept-3-ene;methane
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CID 143708090
(Z)-4-methylsulfanylbut-3-en-1-ol
CID 143469331
ethane;5-methylhex-2-ene;propane
CID 143336274
N-[(E)-3-methylsulfanylprop-2-enyl]methanimine
CID 118675776
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CID 173399515

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-methylsulfanylpent-1-ene?
The IUPAC name of 4-methyl-1-methylsulfanylpent-1-ene (CID 13307684) is 4-methyl-1-methylsulfanylpent-1-ene.
What is the SMILES notation for 4-methyl-1-methylsulfanylpent-1-ene?
The canonical SMILES for 4-methyl-1-methylsulfanylpent-1-ene is CSC=CCC(C)C.
What is the InChIKey of 4-methyl-1-methylsulfanylpent-1-ene?
The InChIKey is GDILMVIZRXYQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14S/c1-7(2)5-4-6-8-3/h4,6-7H,5H2,1-3H3.
What are the key properties of 4-methyl-1-methylsulfanylpent-1-ene?
4-methyl-1-methylsulfanylpent-1-ene has a molecular weight of 130.26 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-methylsulfanylpent-1-ene is sourced from PubChem (CID 13307684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).