trichloro(phenylimino)vanadium

C6H5Cl3NV — CID 6395397

IUPACtrichloro(phenylimino)vanadium
SMILESCl[V](Cl)(Cl)=Nc1ccccc1
InChIInChI=1S/C6H5N.3ClH.V/c7-6-4-2-1-3-5-6;;;;/h1-5H;3*1H;/q;;;;+3/p-3
InChIKeyIFBTUGVUOWGAKS-UHFFFAOYSA-K
MW248.42 g/mol
LogP4.12
Rot. Bonds1

About trichloro(phenylimino)vanadium

trichloro(phenylimino)vanadium (PubChem CID 6395397) has the molecular formula C6H5Cl3NV and a molecular weight of 248.42 g/mol. Its IUPAC name is trichloro(phenylimino)vanadium.

Molecular Properties

Compound Nametrichloro(phenylimino)vanadium
PubChem CID6395397
Molecular FormulaC6H5Cl3NV
Molecular Weight248.42 g/mol
Exact Mass246.89
IUPAC Nametrichloro(phenylimino)vanadium
SMILESCl[V](Cl)(Cl)=Nc1ccccc1
InChIInChI=1S/C6H5N.3ClH.V/c7-6-4-2-1-3-5-6;;;;/h1-5H;3*1H;/q;;;;+3/p-3
InChIKeyIFBTUGVUOWGAKS-UHFFFAOYSA-K
XLogP4.12
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.42
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Aniline
CID 6115
P-Phenylenediamine
CID 7814
Phenyl Isothiocyanate
CID 7673
4-Fluoroaniline
CID 9731
Phenyl isocyanate
CID 7672
1,4-Diaminobenzene dihydrochloride
CID 12205
Benzenamine hydrochloride (1:1)
CID 8870
1,2-Phenylenediamine dihydrochloride
CID 11990
Nitrosobenzene
CID 11473
M-phenylenediamine dihydrochloride
CID 10941
2-Fluoroaniline
CID 9584
4-Iodoaniline
CID 10893

Frequently Asked Questions

What is the IUPAC name of trichloro(phenylimino)vanadium?
The IUPAC name of trichloro(phenylimino)vanadium (CID 6395397) is trichloro(phenylimino)vanadium.
What is the SMILES notation for trichloro(phenylimino)vanadium?
The canonical SMILES for trichloro(phenylimino)vanadium is Cl[V](Cl)(Cl)=Nc1ccccc1.
What is the InChIKey of trichloro(phenylimino)vanadium?
The InChIKey is IFBTUGVUOWGAKS-UHFFFAOYSA-K. The full InChI is InChI=1S/C6H5N.3ClH.V/c7-6-4-2-1-3-5-6;;;;/h1-5H;3*1H;/q;;;;+3/p-3.
What are the key properties of trichloro(phenylimino)vanadium?
trichloro(phenylimino)vanadium has a molecular weight of 248.42 g/mol, XLogP of 4.12, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(phenylimino)vanadium is sourced from PubChem (CID 6395397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).