AG00IRX7

Name: 3-(3,3-dimethyl-2-oxo-1-azetanyl)benzenecarbonitrile
Brand: Angene Chemical
SKU: AG00IRX7

341965-81-9 | 3-(3,3-dimethyl-2-oxo-1-azetanyl)benzenecarbonitrile

AG00IRX7

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CAS Number	341965-81-9
Catalog Number	AG00IRX7(AGN-PC-0WAPID)
Chemical Name	3-(3,3-dimethyl-2-oxo-1-azetanyl)benzenecarbonitrile
IUPAC Name	3-(3,3-dimethyl-2-oxoazetidin-1-yl)benzonitrile
InChI	InChI=1S/C12H12N2O/c1-12(2)8-14(11(12)15)10-5-3-4-9(6-10)7-13/h3-6H,8H2,1-2H3
InChI Key	JBEMABAJEAKDHN-UHFFFAOYSA-N
MDL Number	MFCD00793353
Molecular Formula	C12H12N2O
Molecular Weight	200.2365
SMILES	O=C2(N(C1(=CC(C#N)=CC=C1))CC2(C)C)
Synonyms	3-(3,3-dimethyl-2-oxo-1-azetanyl)benzenecarbonitrile, 341965-81-9, 3-(3,3-dimethyl-2-oxoazetidin-1-yl)benzonitrile, AC1LRPRK, Bionet2_000913, Oprea1_001904, MLS000706846, CHEMBL1866533, KS-00001QVX, HMS1366J11, HMS2654B23, ZINC1387656, MFCD00793353, AKOS015991714, MCULE-7472263550, SMR000334363, ZB016784, 10L-710, ZINC01387656, CID1475549,

Complexity	326
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.095g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	200.241g/mol
Monoisotopic Mass	200.095g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	44.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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