(Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene

C11H22OS — CID 143926230

IUPAC(Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene
SMILESCC/C=C(\SC)C(COC)C(C)C
InChIInChI=1S/C11H22OS/c1-6-7-11(13-5)10(8-12-4)9(2)3/h7,9-10H,6,8H2,1-5H3/b11-7-
InChIKeyZRXZEWHJLBUCSH-XFFZJAGNSA-N
MW202.36 g/mol
LogP3.56
Rot. Bonds6

About (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene

(Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene (PubChem CID 143926230) has the molecular formula C11H22OS and a molecular weight of 202.36 g/mol. Its IUPAC name is (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene.

Molecular Properties

Compound Name(Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene
PubChem CID143926230
Molecular FormulaC11H22OS
Molecular Weight202.36 g/mol
Exact Mass202.14
IUPAC Name(Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene
SMILESCC/C=C(\SC)C(COC)C(C)C
InChIInChI=1S/C11H22OS/c1-6-7-11(13-5)10(8-12-4)9(2)3/h7,9-10H,6,8H2,1-5H3/b11-7-
InChIKeyZRXZEWHJLBUCSH-XFFZJAGNSA-N
XLogP3.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.36
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,5S)-2-(methoxymethyl)-3-methyl-5-propan-2-yl-2,5-dihydrothiophene
CID 101789478
(3Z,6Z)-10-methoxy-9-methyl-9-methylsulfanyldeca-3,6-diene
CID 59931986
7-(1-Butylsulfanylethoxy)-5,6-dimethylhept-3-ene
CID 145634551
(2R)-2-(methoxymethyl)-3-methyl-5-propan-2-yl-2,5-dihydrothiophene
CID 102177919

Frequently Asked Questions

What is the IUPAC name of (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene?
The IUPAC name of (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene (CID 143926230) is (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene.
What is the SMILES notation for (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene?
The canonical SMILES for (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene is CC/C=C(\SC)C(COC)C(C)C.
What is the InChIKey of (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene?
The InChIKey is ZRXZEWHJLBUCSH-XFFZJAGNSA-N. The full InChI is InChI=1S/C11H22OS/c1-6-7-11(13-5)10(8-12-4)9(2)3/h7,9-10H,6,8H2,1-5H3/b11-7-.
What are the key properties of (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene?
(Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene has a molecular weight of 202.36 g/mol, XLogP of 3.56, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-(methoxymethyl)-6-methyl-4-methylsulfanylhept-3-ene is sourced from PubChem (CID 143926230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).