ethene;trichloride

C6H12Cl3-3 — CID 23135135

IUPACethene;trichloride
SMILESC=C.C=C.C=C.[Cl-].[Cl-].[Cl-]
InChIInChI=1S/3C2H4.3ClH/c3*1-2;;;/h3*1-2H2;3*1H/p-3
InChIKeyNTJVEMNVZBCPQL-UHFFFAOYSA-K
MW190.52 g/mol
LogP-6.58
Rot. Bonds

About ethene;trichloride

ethene;trichloride (PubChem CID 23135135) has the molecular formula C6H12Cl3-3 and a molecular weight of 190.52 g/mol. Its IUPAC name is ethene;trichloride.

Molecular Properties

Compound Nameethene;trichloride
PubChem CID23135135
Molecular FormulaC6H12Cl3-3
Molecular Weight190.52 g/mol
Exact Mass189.00
IUPAC Nameethene;trichloride
SMILESC=C.C=C.C=C.[Cl-].[Cl-].[Cl-]
InChIInChI=1S/3C2H4.3ClH/c3*1-2;;;/h3*1-2H2;3*1H/p-3
InChIKeyNTJVEMNVZBCPQL-UHFFFAOYSA-K
XLogP-6.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.52
LogP ≤ 5-6.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

aluminum;ethene;trichloride
CID 160515090
calcium;ethene;trichloride
CID 21413632
azane;ethene
CID 22734726
ethene;methane
CID 158775947
azane;ethene
CID 172863164
ethene;neon
CID 159102047
ethene;sulfane
CID 173042161
CID 172809925
CID 172809925
ethene;indigane
CID 173405443
ethene;trihydrofluoride
CID 172996920
aluminum ethene
CID 19428777
antimony(3+);ethene
CID 22289936

Frequently Asked Questions

What is the IUPAC name of ethene;trichloride?
The IUPAC name of ethene;trichloride (CID 23135135) is ethene;trichloride.
What is the SMILES notation for ethene;trichloride?
The canonical SMILES for ethene;trichloride is C=C.C=C.C=C.[Cl-].[Cl-].[Cl-].
What is the InChIKey of ethene;trichloride?
The InChIKey is NTJVEMNVZBCPQL-UHFFFAOYSA-K. The full InChI is InChI=1S/3C2H4.3ClH/c3*1-2;;;/h3*1-2H2;3*1H/p-3.
What are the key properties of ethene;trichloride?
ethene;trichloride has a molecular weight of 190.52 g/mol, XLogP of -6.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;trichloride is sourced from PubChem (CID 23135135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).