2,4-dichloro-5-fluorobenzamide

C7H4Cl2FNO — CID 2774011

IUPAC2,4-dichloro-5-fluorobenzamide
SMILESNC(=O)c1cc(F)c(Cl)cc1Cl
InChIInChI=1S/C7H4Cl2FNO/c8-4-2-5(9)6(10)1-3(4)7(11)12/h1-2H,(H2,11,12)
InChIKeySKSVSZRFINHARI-UHFFFAOYSA-N
MW208.02 g/mol
LogP2.23
Rot. Bonds1

About 2,4-dichloro-5-fluorobenzamide

2,4-dichloro-5-fluorobenzamide (PubChem CID 2774011) has the molecular formula C7H4Cl2FNO and a molecular weight of 208.02 g/mol. Its IUPAC name is 2,4-dichloro-5-fluorobenzamide.

Molecular Properties

Compound Name2,4-dichloro-5-fluorobenzamide
PubChem CID2774011
Molecular FormulaC7H4Cl2FNO
Molecular Weight208.02 g/mol
Exact Mass206.97
IUPAC Name2,4-dichloro-5-fluorobenzamide
SMILESNC(=O)c1cc(F)c(Cl)cc1Cl
InChIInChI=1S/C7H4Cl2FNO/c8-4-2-5(9)6(10)1-3(4)7(11)12/h1-2H,(H2,11,12)
InChIKeySKSVSZRFINHARI-UHFFFAOYSA-N
XLogP2.23
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.02
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

2,6-Dichlorobenzamide
CID 16183
2-Chlorobenzamide
CID 69111
3-Chlorobenzamide
CID 69254
4-Chlorobenzamide
CID 12084
2,4-Dichlorobenzamide
CID 75556
3-Chloro-4-fluorobenzamide
CID 2736520
2,4-Dichloro-N-hydroxybenzamide
CID 222876
2,4-Dichlorobenzohydrazide
CID 138596
2-Chloro-6-fluorobenzamide
CID 98564
2-Chloro-N-hydroxybenzamide
CID 587397
2,3-Dichlorobenzamide
CID 2735956
2,6-Dichlorobenzohydrazide
CID 19907604

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-fluorobenzamide?
The IUPAC name of 2,4-dichloro-5-fluorobenzamide (CID 2774011) is 2,4-dichloro-5-fluorobenzamide.
What is the SMILES notation for 2,4-dichloro-5-fluorobenzamide?
The canonical SMILES for 2,4-dichloro-5-fluorobenzamide is NC(=O)c1cc(F)c(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-5-fluorobenzamide?
The InChIKey is SKSVSZRFINHARI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Cl2FNO/c8-4-2-5(9)6(10)1-3(4)7(11)12/h1-2H,(H2,11,12).
What are the key properties of 2,4-dichloro-5-fluorobenzamide?
2,4-dichloro-5-fluorobenzamide has a molecular weight of 208.02 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-fluorobenzamide is sourced from PubChem (CID 2774011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).