AG00AQJD

Name: 1-Nitro-3-(trifluoromethane)sulfonylbenzene
Brand: Angene Chemical
SKU: AG00AQJD

1548-72-7 | 1-Nitro-3-(trifluoromethane)sulfonylbenzene

AG00AQJD

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CAS Number	1548-72-7
Catalog Number	AG00AQJD(AGN-PC-0LLSL8)
Chemical Name	1-Nitro-3-(trifluoromethane)sulfonylbenzene
IUPAC Name	1-nitro-3-(trifluoromethylsulfonyl)benzene
InChI	InChI=1S/C7H4F3NO4S/c8-7(9,10)16(14,15)6-3-1-2-5(4-6)11(12)13/h1-4H
InChI Key	KDAOZCLTNCRPFJ-UHFFFAOYSA-N
MDL Number	MFCD00519676
Molecular Formula	C7H4F3NO4S
Molecular Weight	255.1712
SMILES	[O-][N+](=O)c1cccc(c1)S(=O)(=O)C(F)(F)F
Synonyms	1-Nitro-3-(trifluoromethane)sulfonylbenzene, 1548-72-7, 1-nitro-3-(trifluoromethylsulfonyl)benzene, AC1NMK5L, 3-(TRIFLUOROMETHYLSULFONYL)NITROBENZENE, 1-nitro-3-triflyl-benzene, C7H4F3NO4S, SCHEMBL8105215, ZINC3098920, MFCD00519676, AKOS003273041, (3-Nitrophenyl)(trifluoromethyl) sulfone, 1-nitro-3-trifluoromethanesulfonylbenzene, V3510, 1-nitro-3-[(trifluoromethyl)sulfonyl]benzene, K-4893, ZINC03098920, CID5052292,

Complexity	367
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	254.981g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	255.167g/mol
Monoisotopic Mass	254.981g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	88.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited