AG00DH61

Name: 3-((3-Chlorophenyl)amino)propanenitrile
Brand: Angene Chemical
SKU: AG00DH61

54475-92-2 | 3-((3-Chlorophenyl)amino)propanenitrile

AG00DH61

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CAS Number	54475-92-2
Catalog Number	AG00DH61(AGN-PC-0JP9L0)
Chemical Name	3-((3-Chlorophenyl)amino)propanenitrile
IUPAC Name	3-(3-chloroanilino)propanenitrile
InChI	InChI=1S/C9H9ClN2/c10-8-3-1-4-9(7-8)12-6-2-5-11/h1,3-4,7,12H,2,6H2
InChI Key	FHMOSLSCFOUAOT-UHFFFAOYSA-N
MDL Number	MFCD00229047
Molecular Formula	C9H9ClN2
Molecular Weight	180.6342
NSC Number	147652
SMILES	ClC1=CC(NCCC#N)=CC=C1
Synonyms	54475-92-2, 3-(3-chloro-phenylamino)-propionitrile, 3-[(3-chlorophenyl)amino]propanenitrile, 3-((3-Chlorophenyl)amino)propanenitrile, 3-(3-chloroanilino)propanenitrile, 3-(3-chlorophenylamino)propanenitrile, NSC147652, AC1Q3IGB, AC1Q3MLF, AC1Q3KA2, SCHEMBL498891, AC1L67Q4, CTK5A1205, DTXSID50301973, FHMOSLSCFOUAOT-UHFFFAOYSA-N, ZINC1729255, AKOS001039268, MCULE-5687519579, NE20598, NSC-147652, Propanenitrile,3-[(3-chlorophenyl)amino]-, EN300-06718, Z56931866, 3- propanenitrile, AR-1E6591, CID287594, 5457-00-1,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.045g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	180.635g/mol
Monoisotopic Mass	180.045g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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