1,2-difluoro-3-methylbenzene;vanadium

C7H6F2V — CID 170603843

IUPAC1,2-difluoro-3-methylbenzene;vanadium
SMILESCc1cccc(F)c1F.[V]
InChIInChI=1S/C7H6F2.V/c1-5-3-2-4-6(8)7(5)9;/h2-4H,1H3;
InChIKeyQKKOKVLGIRGHGG-UHFFFAOYSA-N
MW179.06 g/mol
LogP2.27
Rot. Bonds

About 1,2-difluoro-3-methylbenzene;vanadium

1,2-difluoro-3-methylbenzene;vanadium (PubChem CID 170603843) has the molecular formula C7H6F2V and a molecular weight of 179.06 g/mol. Its IUPAC name is 1,2-difluoro-3-methylbenzene;vanadium.

Molecular Properties

Compound Name1,2-difluoro-3-methylbenzene;vanadium
PubChem CID170603843
Molecular FormulaC7H6F2V
Molecular Weight179.06 g/mol
Exact Mass178.99
IUPAC Name1,2-difluoro-3-methylbenzene;vanadium
SMILESCc1cccc(F)c1F.[V]
InChIInChI=1S/C7H6F2.V/c1-5-3-2-4-6(8)7(5)9;/h2-4H,1H3;
InChIKeyQKKOKVLGIRGHGG-UHFFFAOYSA-N
XLogP2.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.06
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2-difluoro-3-(2-fluoro-6-methylphenyl)benzene
CID 134620923
1,2,3-trifluorobenzene
CID 15147
chloromethane;2-fluoro-1,3-dimethylbenzene
CID 144572529
1,2-difluoro-5-methylnaphthalene
CID 54417712
1,3-difluoro-2-methylbenzene;ethane;1,2-xylene
CID 142353819
1,2-difluoro-8-methylnaphthalene
CID 138605111
acetylene;1-fluoro-2-methylbenzene
CID 175248306
1-(2,6-difluorophenyl)-2,3-difluorobenzene
CID 91080743
ethane;1-fluoro-2-methylbenzene;methane
CID 143320188
1-fluoro-2,3-dimethylbenzene;formonitrile
CID 144500110
ethane;2-fluoro-6-methylphenol
CID 162729094
1-(2,3-difluorophenyl)-1-(2-methylphenyl)ethanol
CID 63988174

Frequently Asked Questions

What is the IUPAC name of 1,2-difluoro-3-methylbenzene;vanadium?
The IUPAC name of 1,2-difluoro-3-methylbenzene;vanadium (CID 170603843) is 1,2-difluoro-3-methylbenzene;vanadium.
What is the SMILES notation for 1,2-difluoro-3-methylbenzene;vanadium?
The canonical SMILES for 1,2-difluoro-3-methylbenzene;vanadium is Cc1cccc(F)c1F.[V].
What is the InChIKey of 1,2-difluoro-3-methylbenzene;vanadium?
The InChIKey is QKKOKVLGIRGHGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2.V/c1-5-3-2-4-6(8)7(5)9;/h2-4H,1H3;.
What are the key properties of 1,2-difluoro-3-methylbenzene;vanadium?
1,2-difluoro-3-methylbenzene;vanadium has a molecular weight of 179.06 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-difluoro-3-methylbenzene;vanadium is sourced from PubChem (CID 170603843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).