AG00DKLE

Name: 2-(Butylamino)benzonitrile
Brand: Angene Chemical
SKU: AG00DKLE

5589-61-7 | 2-(Butylamino)benzonitrile

AG00DKLE

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CAS Number	5589-61-7
Catalog Number	AG00DKLE(AGN-PC-040T1Z)
Chemical Name	2-(Butylamino)benzonitrile
IUPAC Name	2-(butylamino)benzonitrile
InChI	InChI=1S/C11H14N2/c1-2-3-8-13-11-7-5-4-6-10(11)9-12/h4-7,13H,2-3,8H2,1H3
InChI Key	VJOGMKBPRFJBQC-UHFFFAOYSA-N
MDL Number	MFCD11144682
Molecular Formula	C11H14N2
Molecular Weight	174.2423
SMILES	CCCCNc1ccccc1C#N
Synonyms	2-(Butylamino)benzonitrile, 5589-61-7, 2-Butylaminobenzonitrile, ACMC-209lpz, N-n-butylanthranilonitrile, SCHEMBL3568604, CTK8B1908, DTXSID80632626, VJOGMKBPRFJBQC-UHFFFAOYSA-N, ANW-32421, MFCD11144682, ZINC19921804, AKOS000241156, AJ-75683, CJ-16499, TC-121166, ST24021849, V6614, J3.495.929C, B-8845, C11H14N2,

Complexity	180
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.116g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	174.247g/mol
Monoisotopic Mass	174.116g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	35.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

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