(2,6-dichloro-4-fluorophenyl)urea

C7H5Cl2FN2O — CID 83079264

IUPAC(2,6-dichloro-4-fluorophenyl)urea
SMILESNC(=O)Nc1c(Cl)cc(F)cc1Cl
InChIInChI=1S/C7H5Cl2FN2O/c8-4-1-3(10)2-5(9)6(4)12-7(11)13/h1-2H,(H3,11,12,13)
InChIKeyVIIKNCGOCNLBLC-UHFFFAOYSA-N
MW223.03 g/mol
LogP2.62
Rot. Bonds1

About (2,6-dichloro-4-fluorophenyl)urea

(2,6-dichloro-4-fluorophenyl)urea (PubChem CID 83079264) has the molecular formula C7H5Cl2FN2O and a molecular weight of 223.03 g/mol. Its IUPAC name is (2,6-dichloro-4-fluorophenyl)urea.

Molecular Properties

Compound Name(2,6-dichloro-4-fluorophenyl)urea
PubChem CID83079264
Molecular FormulaC7H5Cl2FN2O
Molecular Weight223.03 g/mol
Exact Mass221.98
IUPAC Name(2,6-dichloro-4-fluorophenyl)urea
SMILESNC(=O)Nc1c(Cl)cc(F)cc1Cl
InChIInChI=1S/C7H5Cl2FN2O/c8-4-1-3(10)2-5(9)6(4)12-7(11)13/h1-2H,(H3,11,12,13)
InChIKeyVIIKNCGOCNLBLC-UHFFFAOYSA-N
XLogP2.62
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.03
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-Chlorophenylurea
CID 8796
1-(3,5-Dichlorophenyl)urea
CID 4165004
1,3-Bis(2-chlorophenyl)urea
CID 236222
N-(2,6-Dichlorophenyl)thiourea
CID 722776
1-(2,4-Dichlorophenyl)-3-hydroxyurea
CID 4295489
1-(2-Chlorophenyl)-3-(2,4-dichlorophenyl)urea
CID 4487707
(3,5-Dichloro-2,4-difluorophenyl)urea
CID 85605436
(2,5-Dichlorophenyl)urea
CID 347954
Urea, 1,1-dimethyl-3-(2,4,6-trichlorophenyl)-
CID 3042578
3-Chlorophenylurea
CID 16075
1,3-Bis(2,4-dichlorophenyl)urea
CID 302958
1,3-Bis(2,6-dichlorophenyl)urea
CID 341926

Frequently Asked Questions

What is the IUPAC name of (2,6-dichloro-4-fluorophenyl)urea?
The IUPAC name of (2,6-dichloro-4-fluorophenyl)urea (CID 83079264) is (2,6-dichloro-4-fluorophenyl)urea.
What is the SMILES notation for (2,6-dichloro-4-fluorophenyl)urea?
The canonical SMILES for (2,6-dichloro-4-fluorophenyl)urea is NC(=O)Nc1c(Cl)cc(F)cc1Cl.
What is the InChIKey of (2,6-dichloro-4-fluorophenyl)urea?
The InChIKey is VIIKNCGOCNLBLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2FN2O/c8-4-1-3(10)2-5(9)6(4)12-7(11)13/h1-2H,(H3,11,12,13).
What are the key properties of (2,6-dichloro-4-fluorophenyl)urea?
(2,6-dichloro-4-fluorophenyl)urea has a molecular weight of 223.03 g/mol, XLogP of 2.62, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dichloro-4-fluorophenyl)urea is sourced from PubChem (CID 83079264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).