AG009WZL

Name: 1-Butyl-1,3-benzodiazole-5-carbonitrile
Brand: Angene Chemical
SKU: AG009WZL

1403483-90-8 | 1-Butyl-1,3-benzodiazole-5-carbonitrile

AG009WZL

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CAS Number	1403483-90-8
Catalog Number	AG009WZL(AGN-PC-0WA4HE)
Chemical Name	1-Butyl-1,3-benzodiazole-5-carbonitrile
IUPAC Name	1-butylbenzimidazole-5-carbonitrile
InChI	InChI=1S/C12H13N3/c1-2-3-6-15-9-14-11-7-10(8-13)4-5-12(11)15/h4-5,7,9H,2-3,6H2,1H3
InChI Key	CRDWQTFMKLJZAP-UHFFFAOYSA-N
MDL Number	MFCD22549339
Molecular Formula	C12H13N3
Molecular Weight	199.2517
SMILES	CCCCn1cnc2c1ccc(c2)C#N
Synonyms	1-Butyl-1,3-benzodiazole-5-carbonitrile, 1403483-90-8, SCHEMBL19915848, ZINC95496043, V3085, C12H13N3,

Complexity	255
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.111g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.257g/mol
Monoisotopic Mass	199.111g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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