1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene

C7H3Cl2F3 — CID 119004483

IUPAC1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene
SMILESFc1cc(Cl)cc(Cl)c1C(F)F
InChIInChI=1S/C7H3Cl2F3/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,7H
InChIKeyVCOVJFYKTARMTE-UHFFFAOYSA-N
MW215.00 g/mol
LogP4.07
Rot. Bonds1

About 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene

1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene (PubChem CID 119004483) has the molecular formula C7H3Cl2F3 and a molecular weight of 215.00 g/mol. Its IUPAC name is 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene.

Molecular Properties

Compound Name1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene
PubChem CID119004483
Molecular FormulaC7H3Cl2F3
Molecular Weight215.00 g/mol
Exact Mass213.96
IUPAC Name1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene
SMILESFc1cc(Cl)cc(Cl)c1C(F)F
InChIInChI=1S/C7H3Cl2F3/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,7H
InChIKeyVCOVJFYKTARMTE-UHFFFAOYSA-N
XLogP4.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.00
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2R)-2-(2,4-dichloro-6-fluorophenyl)-2-hydroxyacetic acid
CID 125129364
1,5-dichloro-3-fluoro-2-iodobenzene
CID 50998607
1-chloro-2-(difluoromethyl)-4-fluoro-3-methylbenzene
CID 130863176
(1R)-1-(4-chloro-2,6-difluorophenyl)-2-fluoroethanamine;hydrochloride
CID 171230517
1-chloro-2-(difluoromethyl)-4-fluoro-3-iodobenzene
CID 171004047
3-bromo-1-chloro-2-(difluoromethyl)-4-fluorobenzene
CID 119013054
1,5-dichloro-3-fluoro-2-methylbenzene;ethane
CID 142574555
5-chloro-2-(difluoromethyl)-1,3-bis(trifluoromethyl)benzene
CID 119001959
2,4-dichloro-1-[3-chloro-2-(difluoromethyl)phenyl]benzene
CID 134625949
3-chloro-6-(2,4-dichlorophenoxy)-2-(difluoromethyl)phenol
CID 86576202
1,5-dichloro-3-fluoro-2-propan-2-yloxybenzene
CID 125116033
(1R)-1-(4-chloro-2,6-difluorophenyl)-3,3,3-trifluoropropan-1-amine
CID 131403549

Frequently Asked Questions

What is the IUPAC name of 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene?
The IUPAC name of 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene (CID 119004483) is 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene.
What is the SMILES notation for 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene?
The canonical SMILES for 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene is Fc1cc(Cl)cc(Cl)c1C(F)F.
What is the InChIKey of 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene?
The InChIKey is VCOVJFYKTARMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3Cl2F3/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,7H.
What are the key properties of 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene?
1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene has a molecular weight of 215.00 g/mol, XLogP of 4.07, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dichloro-2-(difluoromethyl)-3-fluorobenzene is sourced from PubChem (CID 119004483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).