1,3-dichlorobenzene;trihydrofluoride

C6H7Cl2F3 — CID 172846672

IUPAC1,3-dichlorobenzene;trihydrofluoride
SMILESClc1cccc(Cl)c1.F.F.F
InChIInChI=1S/C6H4Cl2.3FH/c7-5-2-1-3-6(8)4-5;;;/h1-4H;3*1H
InChIKeyXNBFHBQUXRHLAF-UHFFFAOYSA-N
MW207.02 g/mol
LogP3.45
Rot. Bonds

About 1,3-dichlorobenzene;trihydrofluoride

1,3-dichlorobenzene;trihydrofluoride (PubChem CID 172846672) has the molecular formula C6H7Cl2F3 and a molecular weight of 207.02 g/mol. Its IUPAC name is 1,3-dichlorobenzene;trihydrofluoride.

Molecular Properties

Compound Name1,3-dichlorobenzene;trihydrofluoride
PubChem CID172846672
Molecular FormulaC6H7Cl2F3
Molecular Weight207.02 g/mol
Exact Mass205.99
IUPAC Name1,3-dichlorobenzene;trihydrofluoride
SMILESClc1cccc(Cl)c1.F.F.F
InChIInChI=1S/C6H4Cl2.3FH/c7-5-2-1-3-6(8)4-5;;;/h1-4H;3*1H
InChIKeyXNBFHBQUXRHLAF-UHFFFAOYSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.02
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

azane;1,3-dichlorobenzene
CID 67301049
magnesium;1,3-dichlorobenzene;hydride
CID 173052292
sodium;1,3-dichlorobenzene;hydride
CID 175271520
1,3-dichlorobenzene;sulfanol
CID 174381890
butane;1,3-dichlorobenzene
CID 174455068
1,3-dichlorobenzene;guanidine
CID 174959611
CID 11133415
CID 11133415
acetic acid;1,3-dichlorobenzene;hydrate
CID 118105432
chloro-tris(3-chlorophenyl)stannane
CID 12643231
3-chloro-1-fluoro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
CID 71309867
1,3-dichlorobenzene;2,4-dichlorophenol
CID 141496393
tris(1-chloro-3-methylbenzene);ethane
CID 143147725

Frequently Asked Questions

What is the IUPAC name of 1,3-dichlorobenzene;trihydrofluoride?
The IUPAC name of 1,3-dichlorobenzene;trihydrofluoride (CID 172846672) is 1,3-dichlorobenzene;trihydrofluoride.
What is the SMILES notation for 1,3-dichlorobenzene;trihydrofluoride?
The canonical SMILES for 1,3-dichlorobenzene;trihydrofluoride is Clc1cccc(Cl)c1.F.F.F.
What is the InChIKey of 1,3-dichlorobenzene;trihydrofluoride?
The InChIKey is XNBFHBQUXRHLAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl2.3FH/c7-5-2-1-3-6(8)4-5;;;/h1-4H;3*1H.
What are the key properties of 1,3-dichlorobenzene;trihydrofluoride?
1,3-dichlorobenzene;trihydrofluoride has a molecular weight of 207.02 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dichlorobenzene;trihydrofluoride is sourced from PubChem (CID 172846672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).