CID 74764939

C8H20Cl3Sn — CID 74764939

IUPAC—
SMILESCCCCCCCC[Sn].Cl.Cl.Cl
InChIInChI=1S/C8H17.3ClH.Sn/c1-3-5-7-8-6-4-2;;;;/h1,3-8H2,2H3;3*1H;
InChIKeyURNHPNJVPYDKCM-UHFFFAOYSA-N
MW341.32 g/mol
LogP4.20
Rot. Bonds6

About CID 74764939

CID 74764939 (PubChem CID 74764939) has the molecular formula C8H20Cl3Sn and a molecular weight of 341.32 g/mol.

Molecular Properties

Compound NameCID 74764939
PubChem CID74764939
Molecular FormulaC8H20Cl3Sn
Molecular Weight341.32 g/mol
Exact Mass340.97
IUPAC Name—
SMILESCCCCCCCC[Sn].Cl.Cl.Cl
InChIInChI=1S/C8H17.3ClH.Sn/c1-3-5-7-8-6-4-2;;;;/h1,3-8H2,2H3;3*1H;
InChIKeyURNHPNJVPYDKCM-UHFFFAOYSA-N
XLogP4.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.32
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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icosane;tetrahydrochloride
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pentacosane;hydrochloride
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nonadecane;hydrochloride
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octane;oxotin;hydrochloride
CID 173066555
methane;octane;dihydrochloride
CID 174397937
heptane;phosphane;trihydrochloride
CID 175501735
azane;tritriacontane;hydrochloride
CID 174841743
heptane;silane;trihydrochloride
CID 173470147
bis(octane);silane;dihydrochloride
CID 173470119

Frequently Asked Questions

What is the IUPAC name of CID 74764939?
The IUPAC name of CID 74764939 (CID 74764939) is not available.
What is the SMILES notation for CID 74764939?
The canonical SMILES for CID 74764939 is CCCCCCCC[Sn].Cl.Cl.Cl.
What is the InChIKey of CID 74764939?
The InChIKey is URNHPNJVPYDKCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17.3ClH.Sn/c1-3-5-7-8-6-4-2;;;;/h1,3-8H2,2H3;3*1H;.
What are the key properties of CID 74764939?
CID 74764939 has a molecular weight of 341.32 g/mol, XLogP of 4.20, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 74764939 is sourced from PubChem (CID 74764939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).