AG005RCZ

Name: Benzeneethanethioamide,4-nitro-
Brand: Angene Chemical
SKU: AG005RCZ

76254-70-1 | Benzeneethanethioamide,4-nitro-

AG005RCZ

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CAS Number	76254-70-1
Catalog Number	AG005RCZ(AGN-PC-0KKY5U)
Chemical Name	Benzeneethanethioamide,4-nitro-
IUPAC Name	2-(4-nitrophenyl)ethanethioamide
InChI	InChI=1S/C8H8N2O2S/c9-8(13)5-6-1-3-7(4-2-6)10(11)12/h1-4H,5H2,(H2,9,13)
InChI Key	NTDKSXYIORROEJ-UHFFFAOYSA-N
MDL Number	MFCD00278445
Molecular Formula	C8H8N2O2S
Molecular Weight	196.2263
SMILES	NC(CC1=CC=C([N+]([O-])=O)C=C1)=S
Synonyms	2-(4-nitrophenyl)ethanethioamide, 76254-70-1, Benzeneethanethioamide,4-nitro-, AC1MCRN0, 4-Nitrobenzenethioacetamide, AC1Q500N, SCHEMBL1829314, 2-(4-Nitrophenyl)thioacetamide, 2-(4-nitrophenyl)-thioacetamide, CTK5E2665, DTXSID10380481, NTDKSXYIORROEJ-UHFFFAOYSA-N, ZINC159774, 2-(4-Nitrophenyl)ethane thioamide, KS-00002A5L, ZX-AT003952, FCH919036, KM1749, MFCD00278445, SBB092018, AKOS006229043, 4-(2-Amino-2-thioxoethyl)nitrobenzene, MCULE-3808970264, OR24109, PS-4332, ZB007283, 1-amino-2-(4-nitrophenyl)ethane-1-thione, DB-075092, FT-0691247, 254N701, I14-92643, 2- ethanethioamide, ZINC00159774, CID2777337,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.031g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.224g/mol
Monoisotopic Mass	196.031g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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