AG00I014

Name: 2-Methanesulfonyl-5-nitrobenzonitrile
Brand: Angene Chemical
SKU: AG00I014

180297-57-8 | 2-Methanesulfonyl-5-nitrobenzonitrile

AG00I014

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CAS Number	180297-57-8
Catalog Number	AG00I014(AGN-PC-0WQWTY)
Chemical Name	2-Methanesulfonyl-5-nitrobenzonitrile
IUPAC Name	2-methylsulfonyl-5-nitrobenzonitrile
InChI	InChI=1S/C8H6N2O4S/c1-15(13,14)8-3-2-7(10(11)12)4-6(8)5-9/h2-4H,1H3
InChI Key	OTEUADHWTAXVNH-UHFFFAOYSA-N
MDL Number	MFCD28962761
Molecular Formula	C8H6N2O4S
Molecular Weight	226.2092
SMILES	N#Cc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Synonyms	2-Methanesulfonyl-5-nitrobenzonitrile, 180297-57-8, ZINC242592412,

Complexity	397
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	226.005g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	226.206g/mol
Monoisotopic Mass	226.005g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	112A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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