3,4-Difluorobenzoyl chloride - CAS 76903-88-3

Catalog:	BB035741
Product Name:	3,4-Difluorobenzoyl chloride
CAS:	76903-88-3
Synonyms:	3,4-difluorobenzoyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3,4-difluorobenzoyl chloride
Description:	3,4-Difluorobenzoyl chloride (CAS# 76903-88-3) is a useful research chemical.
Molecular Weight:	176.55
Molecular Formula:	C7H3ClF2O
Canonical SMILES:	C1=CC(=C(C=C1C(=O)Cl)F)F
InChI:	InChI=1S/C7H3ClF2O/c8-7(11)4-1-2-5(9)6(10)3-4/h1-3H
InChI Key:	RPQWXGVZELKOEU-UHFFFAOYSA-N
Boiling Point:	61-63 °C (15 mmHg)
Purity:	95 %
Density:	1.403 g/cm³
Appearance:	Clear yellow liquid
MDL:	MFCD00009930
LogP:	2.34380

Publication Number	Title	Priority Date
CN-113307768-A	Quinolone derivative and preparation method and application thereof	20210429
WO-2021022061-A1	Aryl hydrocarbon receptor activators	20190730
CN-110143941-A	A kind of synthetic method of Barrow Sa Weimabo ester intermediate	20190604
CN-110143941-B	Synthesis method of intermediate of balusavir mefene	20190604
WO-2020157189-A1	1,2,4-triazin-6(1h)-one compounds for the treatment of hyperproliferative diseases	20190201

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

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
[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[452-76-6]
2,4-Difluorotoluene
[151585-93-2]
2-Amino-6-fluorobenzaldehyde
[1597-32-6]
2-Amino-6-fluoropyridine

Other Pyrimidines

[452-76-6]
2,4-Difluorotoluene
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[81290-20-2]
Trimethyl(trifluoromethyl)silane
[1489-53-8]
1,2,3-Trifluorobenzene
[860790-29-0]
N-[4-Cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine
[67490-21-5]
2,4,6-Tri-tert-butylpyrimidine

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	175.9840487
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	175.9840487
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8