chlorozinc(1+);1-methylsulfanylnon-1-ene

C10H19ClSZn — CID 134893879

IUPACchlorozinc(1+);1-methylsulfanylnon-1-ene
SMILESCCCCCCC/C=[C-]\SC.Cl[Zn+]
InChIInChI=1S/C10H19S.ClH.Zn/c1-3-4-5-6-7-8-9-10-11-2;;/h9H,3-8H2,1-2H3;1H;/q-1;;+2/p-1
InChIKeyUWHPBYPXEGKLIA-UHFFFAOYSA-M
MW272.17 g/mol
LogP4.71
Rot. Bonds7

About chlorozinc(1+);1-methylsulfanylnon-1-ene

chlorozinc(1+);1-methylsulfanylnon-1-ene (PubChem CID 134893879) has the molecular formula C10H19ClSZn and a molecular weight of 272.17 g/mol. Its IUPAC name is chlorozinc(1+);1-methylsulfanylnon-1-ene.

Molecular Properties

Compound Namechlorozinc(1+);1-methylsulfanylnon-1-ene
PubChem CID134893879
Molecular FormulaC10H19ClSZn
Molecular Weight272.17 g/mol
Exact Mass270.02
IUPAC Namechlorozinc(1+);1-methylsulfanylnon-1-ene
SMILESCCCCCCC/C=[C-]\SC.Cl[Zn+]
InChIInChI=1S/C10H19S.ClH.Zn/c1-3-4-5-6-7-8-9-10-11-2;;/h9H,3-8H2,1-2H3;1H;/q-1;;+2/p-1
InChIKeyUWHPBYPXEGKLIA-UHFFFAOYSA-M
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.17
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chlorozinc(1+);1-methylsulfanylnon-1-ene?
The IUPAC name of chlorozinc(1+);1-methylsulfanylnon-1-ene (CID 134893879) is chlorozinc(1+);1-methylsulfanylnon-1-ene.
What is the SMILES notation for chlorozinc(1+);1-methylsulfanylnon-1-ene?
The canonical SMILES for chlorozinc(1+);1-methylsulfanylnon-1-ene is CCCCCCC/C=[C-]\SC.Cl[Zn+].
What is the InChIKey of chlorozinc(1+);1-methylsulfanylnon-1-ene?
The InChIKey is UWHPBYPXEGKLIA-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H19S.ClH.Zn/c1-3-4-5-6-7-8-9-10-11-2;;/h9H,3-8H2,1-2H3;1H;/q-1;;+2/p-1.
What are the key properties of chlorozinc(1+);1-methylsulfanylnon-1-ene?
chlorozinc(1+);1-methylsulfanylnon-1-ene has a molecular weight of 272.17 g/mol, XLogP of 4.71, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chlorozinc(1+);1-methylsulfanylnon-1-ene is sourced from PubChem (CID 134893879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).