3,4-Difluorobenzamide - CAS 85118-04-3

Catalog:	BB037492
Product Name:	3,4-Difluorobenzamide
CAS:	85118-04-3
Synonyms:	3,4-difluorobenzamide

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3,4-difluorobenzamide
Description:	3,4-Difluorobenzamide (CAS# 85118-04-3) is a useful research chemical.
Molecular Weight:	157.12
Molecular Formula:	C7H5F2NO
Canonical SMILES:	C1=CC(=C(C=C1C(=O)N)F)F
InChI:	InChI=1S/C7H5F2NO/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H2,10,11)
InChI Key:	CMWOHNIHUBDEAG-UHFFFAOYSA-N
Boiling Point:	210 °C at 760 mmHg
Density:	1.348 g/cm³
Appearance:	Crystalline powder
MDL:	MFCD00015549
LogP:	1.76400

Publication Number	Title	Priority Date
WO-2021194908-A1	Modified dipeptide cleavases, uses thereof and related kits	20200324
US-2021214701-A1	Modified cleavases, uses thereof and related kits	20190326
JP-2021524484-A	3- (5-Hydroxy-1-oxoisoindoline-2-yl) piperidine-2,6-dione derivative and its use in the treatment of Ikaros family zinc finger 2 (IKZF2) -dependent diseases	20180710
US-2020268688-A1	Fluorophenyl beta-hydroxyethylamines and their use in the treatment of hyperglycaemia	20170913
EP-3645531-A1	Thiazole compounds useful as prmt5 inhibitors	20170629

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[87-88-7]
Chloranilic acid
[1427004-19-0]
DBCO-PEG4-NHS ester
[17746-05-3]
Undecanoyl chloride
[55441-25-3]
1-(2-Cyanophenyl)urea
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone

Fluorinated Building Blocks

[1006473-17-1]
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[452-76-6]
2,4-Difluorotoluene

Other Pyrimidines

[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[1597-32-6]
2-Amino-6-fluoropyridine
[2696462-69-6]
4-(4-Aminopyrimidin-2-yl)-2-methyl-1-(2-trimethylsilylethoxymethyl)pyrazol-3-one
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[81290-20-2]
Trimethyl(trifluoromethyl)silane

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	157.03392011
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	157.03392011
Rotatable Bond Count:	1
Topological Polar Surface Area:	43.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2