(Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene

C10H18S — CID 170213109

IUPAC(Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene
SMILESC/C=C\S/C(=C\C)C(C)(C)C
InChIInChI=1S/C10H18S/c1-6-8-11-9(7-2)10(3,4)5/h6-8H,1-5H3/b8-6-,9-7-
InChIKeyXHJJZRSNAZPIIE-VRHVFUOLSA-N
MW170.32 g/mol
LogP4.20
Rot. Bonds2

About (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene

(Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene (PubChem CID 170213109) has the molecular formula C10H18S and a molecular weight of 170.32 g/mol. Its IUPAC name is (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene.

Molecular Properties

Compound Name(Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene
PubChem CID170213109
Molecular FormulaC10H18S
Molecular Weight170.32 g/mol
Exact Mass170.11
IUPAC Name(Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene
SMILESC/C=C\S/C(=C\C)C(C)(C)C
InChIInChI=1S/C10H18S/c1-6-8-11-9(7-2)10(3,4)5/h6-8H,1-5H3/b8-6-,9-7-
InChIKeyXHJJZRSNAZPIIE-VRHVFUOLSA-N
XLogP4.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.32
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene?
The IUPAC name of (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene (CID 170213109) is (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene.
What is the SMILES notation for (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene?
The canonical SMILES for (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene is C/C=C\S/C(=C\C)C(C)(C)C.
What is the InChIKey of (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene?
The InChIKey is XHJJZRSNAZPIIE-VRHVFUOLSA-N. The full InChI is InChI=1S/C10H18S/c1-6-8-11-9(7-2)10(3,4)5/h6-8H,1-5H3/b8-6-,9-7-.
What are the key properties of (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene?
(Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene has a molecular weight of 170.32 g/mol, XLogP of 4.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4,4-dimethyl-3-[(Z)-prop-1-enyl]sulfanylpent-2-ene is sourced from PubChem (CID 170213109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).