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69399-79-7,MFCD00055650
Catalog No.:AA003HXP
69399-79-7 | 3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride
Pack Size
Purity
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Price(USD)
Quantity
  
1g
60%
in stock  
$29.00   $20.00
- +
5g
60%
in stock  
$65.00   $45.00
- +
10g
60%
in stock  
$100.00   $70.00
- +
25g
60%
in stock  
$200.00   $140.00
- +
100g
60%
in stock  
$667.00   $467.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA003HXP
Chemical Name:
3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride
CAS Number:
69399-79-7
Molecular Formula:
C11H6Cl2FNO2
Molecular Weight:
274.0752
MDL Number:
MFCD00055650
IUPAC Name:
3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride
InChI:
InChI=1S/C11H6Cl2FNO2/c1-5-8(11(13)16)10(15-17-5)9-6(12)3-2-4-7(9)14/h2-4H,1H3
InChI Key:
XJCUKCOLGJDGGN-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1c1noc(c1C(=O)Cl)C)Cl
EC Number:
273-987-0
Properties
Computed Properties
 
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.976g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.072g/mol
Monoisotopic Mass:
272.976g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

Synonyms
 
3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride 
69399-79-7 
3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonylchloride 
EINECS 273-987-0 
PubChem8771 
AC1MC5WL 
AC1Q2DHM 
SCHEMBL1065677 
CTK2F6436 
DTXSID40219518 
PC1886P 
BCP19466 
XJCUKCOLGJDGGN-UHFFFAOYSA-N 
ZINC2169435 
ZX-AP001678 
ANW-44055 
MFCD00055650 
SBB053651 
AKOS000121250 
HCH0020282 
MCULE-1961320582 
RP29696 
TRA0013949 
3-(2-Chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carbonyl chloride 
SEL10401482 
NCGC00253745-01 
AC-10858 
AJ-33976 
AK-94164 
AN-37934 
AS-40172 
BP-10349 
CC-12262 
K156 
W-104628 
SC-62353 
AX8022223 
DB-021586 
TC-132800 
FT-0613537 
ST24041394 
399C797 
A836477 
C-17258 
SR-01000944787 
Fcimic chloride 
I01-0994 
SR-01000944787-1 
3-(2-chloro-6-fluorophenyl)-5-methylisoxaz-4-oyl chloride 
3-(2-Chloro-6-fluorophenyl)5-methylisoxaz-4-oyl chloride 
3-(2-chloro-6-fluorophenyl)-5-methyl-4-chlorocarbonylisoxazole 
3-(2-Chloro-6-fluorophenyl)-5-methylisoxazol-4-oyl chloride 
3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYLISOXAZOLE-4-CA 
3-(2-chloro-6-fluoro-phenyl)-5-methylisoxazole-4-carbonyl chloride 
3-(2-chloro-6-fluorophenyl)-5-methylisoxazole4-carbonyl chloride 
3-(6-chloro-2-fluorophenyl)-5-methylisoxazole4-carbonyl chloride 
3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride 
4-Isoxazolecarbonylchloride, 3-(2-chloro-6-fluorophenyl)-5-methyl- 
3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid chloride 
4-Isoxazolecarbonyl chloride, 3-(2-chloro-6-fluorophenyl)-5-methyl- 
3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride 
C11H6Cl2FNO2 
cc-196 
C11-H6-Cl2-F-N-O2 
ZINC02169435 
CID2736581 
3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarbonyl chloride 
3-(6-chloro-2-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride 
3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYL ISOXAZOLE-4-CARBONYL CHLORIDE 
Literature
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