AG00DN49

Name: 3-((2-Aminophenyl)thio)propanenitrile
Brand: Angene Chemical
SKU: AG00DN49

4327-52-0 | 3-((2-Aminophenyl)thio)propanenitrile

AG00DN49

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CAS Number	4327-52-0
Catalog Number	AG00DN49(AGN-PC-0KKYTH)
Chemical Name	3-((2-Aminophenyl)thio)propanenitrile
IUPAC Name	3-(2-aminophenyl)sulfanylpropanenitrile
InChI	InChI=1S/C9H10N2S/c10-6-3-7-12-9-5-2-1-4-8(9)11/h1-2,4-5H,3,7,11H2
InChI Key	QPVYTARWIXLUFZ-UHFFFAOYSA-N
MDL Number	MFCD00047835
Molecular Formula	C9H10N2S
Molecular Weight	178.2541
SMILES	NC1=C(SCCC#N)C=CC=C1
Synonyms	4327-52-0, 3-[(2-aminophenyl)thio]propanenitrile, 3-[(2-aminophenyl)sulfanyl]propanenitrile, 3-((2-Aminophenyl)thio)propanenitrile, AC1MCT22, AC1Q51AP, 2-(2-Cyanoethylthio)aniline, CTK4I7220, DTXSID60380870, 3-(2-aminophenylthio)propanenitrile, ZINC2563283, MFCD00047835, AKOS000169961, MCULE-9045150646, NE11030, 3-(2-aminophenyl)sulfanylpropanenitrile, Propanenitrile,3-[(2-aminophenyl)thio]-, FT-0692045, EN300-72785, Z1266854863, ZINC02563283, CID2778332,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.056g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.253g/mol
Monoisotopic Mass	178.056g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	75.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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