AG00IB0L

Name: 3-Cyano-N-isopropylbenzamide
Brand: Angene Chemical
SKU: AG00IB0L

623569-57-3 | 3-Cyano-N-isopropylbenzamide

AG00IB0L

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CAS Number	623569-57-3
Catalog Number	AG00IB0L(AGN-PC-0206RJ)
Chemical Name	3-Cyano-N-isopropylbenzamide
IUPAC Name	3-cyano-N-propan-2-ylbenzamide
InChI	InChI=1S/C11H12N2O/c1-8(2)13-11(14)10-5-3-4-9(6-10)7-12/h3-6,8H,1-2H3,(H,13,14)
InChI Key	RPELRXQGKOWZPC-UHFFFAOYSA-N
MDL Number	MFCD09940478
Molecular Formula	C11H12N2O
Molecular Weight	188.2258
SMILES	N#Cc1cccc(c1)C(=O)NC(C)C
Synonyms	3-Cyano-N-isopropylbenzamide, 623569-57-3, SCHEMBL12251421, ZINC13020862, AKOS000183515, MCULE-8691838382, Benzamide, 3-cyano-N-(1-methylethyl)-,

Complexity	251
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.095g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	188.23g/mol
Monoisotopic Mass	188.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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