tetrachloromethane

CCl4 — CID 5943

💊View drug profile → carbon tetrachloride
IUPACtetrachloromethane
SMILESClC(Cl)(Cl)Cl
InChIInChI=1S/CCl4/c2-1(3,4)5
InChIKeyVZGDMQKNWNREIO-UHFFFAOYSA-N
MW153.82 g/mol
LogP2.55
Rot. Bonds

About tetrachloromethane

tetrachloromethane (PubChem CID 5943) has the molecular formula CCl4 and a molecular weight of 153.82 g/mol. Its IUPAC name is tetrachloromethane.

Molecular Properties

Compound Nametetrachloromethane
PubChem CID5943
Molecular FormulaCCl4
Molecular Weight153.82 g/mol
Exact Mass151.88
IUPAC Nametetrachloromethane
SMILESClC(Cl)(Cl)Cl
InChIInChI=1S/CCl4/c2-1(3,4)5
InChIKeyVZGDMQKNWNREIO-UHFFFAOYSA-N
XLogP2.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.82
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Methane-13C, tetrachloro-
CID 13767014
Chlorwasserstoff Tetrachlorkohlenstoff
CID 20487750
Tetrachloride dihydrochloride
CID 139954008
Dichloro-methylene chlorine
CID 129764339
tetrachloro(111C)methane
CID 9855527
Argon;tetrachloromethane
CID 20035291
Helium;tetrachloromethane
CID 20134741
Hydron;tetrachloromethane;chloride
CID 21564031
Chloro-[(chloro-lambda3-chloranylidene)methylidene]-lambda3-chlorane
CID 22943909
Chlorine tetrachloromethane
CID 86737392
Hydron;tetrachloromethane
CID 88401062
Trichloro(chlorochloranuidyl)methane
CID 153745346

Frequently Asked Questions

What is the IUPAC name of tetrachloromethane?
The IUPAC name of tetrachloromethane (CID 5943) is tetrachloromethane.
What is the SMILES notation for tetrachloromethane?
The canonical SMILES for tetrachloromethane is ClC(Cl)(Cl)Cl.
What is the InChIKey of tetrachloromethane?
The InChIKey is VZGDMQKNWNREIO-UHFFFAOYSA-N. The full InChI is InChI=1S/CCl4/c2-1(3,4)5.
What are the key properties of tetrachloromethane?
tetrachloromethane has a molecular weight of 153.82 g/mol, XLogP of 2.55, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrachloromethane is sourced from PubChem (CID 5943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).