[(Z)-pent-1-enyl]sulfanylbenzene

C11H14S — CID 10397364

IUPAC[(Z)-pent-1-enyl]sulfanylbenzene
SMILESCCC/C=C\Sc1ccccc1
InChIInChI=1S/C11H14S/c1-2-3-7-10-12-11-8-5-4-6-9-11/h4-10H,2-3H2,1H3/b10-7-
InChIKeyKCOAKHNGSIVKOG-YFHOEESVSA-N
MW178.30 g/mol
LogP4.09
Rot. Bonds4

About [(Z)-pent-1-enyl]sulfanylbenzene

[(Z)-pent-1-enyl]sulfanylbenzene (PubChem CID 10397364) has the molecular formula C11H14S and a molecular weight of 178.30 g/mol. Its IUPAC name is [(Z)-pent-1-enyl]sulfanylbenzene.

Molecular Properties

Compound Name[(Z)-pent-1-enyl]sulfanylbenzene
PubChem CID10397364
Molecular FormulaC11H14S
Molecular Weight178.30 g/mol
Exact Mass178.08
IUPAC Name[(Z)-pent-1-enyl]sulfanylbenzene
SMILESCCC/C=C\Sc1ccccc1
InChIInChI=1S/C11H14S/c1-2-3-7-10-12-11-8-5-4-6-9-11/h4-10H,2-3H2,1H3/b10-7-
InChIKeyKCOAKHNGSIVKOG-YFHOEESVSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.30
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

non-1-enylsulfanylbenzene
CID 72760837
[(E)-but-1-enyl]sulfanylbenzene
CID 5463005
(E)-4-phenylsulfanylbut-3-en-1-ol
CID 10821256
[(E)-4-phenylsulfanylbut-1-enyl]sulfanylbenzene
CID 15920993
(Z)-3-phenylsulfanylprop-2-en-1-ol
CID 12685459
(E)-1-phenylsulfanylpent-1-en-3-one
CID 14224807
6-phenylsulfanyl-N-prop-2-enylhex-5-en-1-amine
CID 135044251
3-phenylsulfanylprop-2-enyl acetate
CID 85397386
tert-butyl 2,2-bis(phenylsulfanyl)-2-[(E)-4-phenylsulfanylbut-3-enoxy]acetate
CID 11103230
(E)-1-phenyl-4-phenylsulfanylbut-3-en-1-ol
CID 12653805
tert-butyl 2-(4-phenylsulfanylbut-3-enoxy)acetate
CID 85308894
ethane;[(E)-pent-1-enyl]benzene
CID 143265687

Frequently Asked Questions

What is the IUPAC name of [(Z)-pent-1-enyl]sulfanylbenzene?
The IUPAC name of [(Z)-pent-1-enyl]sulfanylbenzene (CID 10397364) is [(Z)-pent-1-enyl]sulfanylbenzene.
What is the SMILES notation for [(Z)-pent-1-enyl]sulfanylbenzene?
The canonical SMILES for [(Z)-pent-1-enyl]sulfanylbenzene is CCC/C=C\Sc1ccccc1.
What is the InChIKey of [(Z)-pent-1-enyl]sulfanylbenzene?
The InChIKey is KCOAKHNGSIVKOG-YFHOEESVSA-N. The full InChI is InChI=1S/C11H14S/c1-2-3-7-10-12-11-8-5-4-6-9-11/h4-10H,2-3H2,1H3/b10-7-.
What are the key properties of [(Z)-pent-1-enyl]sulfanylbenzene?
[(Z)-pent-1-enyl]sulfanylbenzene has a molecular weight of 178.30 g/mol, XLogP of 4.09, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-pent-1-enyl]sulfanylbenzene is sourced from PubChem (CID 10397364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).