AG0026R7

Name: 1-(2-Fluorophenyl)-4-Oxocyclohexanecarbonitrile
Brand: Angene Chemical
SKU: AG0026R7

179064-61-0 | 1-(2-Fluorophenyl)-4-Oxocyclohexanecarbonitrile

AG0026R7

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CAS Number	179064-61-0
Catalog Number	AG0026R7(AGN-PC-03GEB4)
Chemical Name	1-(2-Fluorophenyl)-4-Oxocyclohexanecarbonitrile
IUPAC Name	1-(2-fluorophenyl)-4-oxocyclohexane-1-carbonitrile
InChI	InChI=1S/C13H12FNO/c14-12-4-2-1-3-11(12)13(9-15)7-5-10(16)6-8-13/h1-4H,5-8H2
InChI Key	SLIRWSUQYAHPHU-UHFFFAOYSA-N
MDL Number	MFCD11849774
Molecular Formula	C13H12FNO
Molecular Weight	217.2389
SMILES	FC1(=C(C=CC=C1)C2(C#N)(CCC(=O)CC2))
Synonyms	179064-61-0, 1-(2-Fluorophenyl)-4-oxocyclohexanecarbonitrile, 1-(2-fluorophenyl)-4-oxocyclohexane-1-carbonitrile, 4-cyano-4-(2-fluorophenyl)cyclohexanone, 4-Cyano-4-(2-fluorophenyl)cyclohexan-1-one, SCHEMBL1557008, CTK0A6796, DTXSID70618631, SLIRWSUQYAHPHU-UHFFFAOYSA-N, KS-00002B1Q, ZX-RL000500, 5993AD, MFCD11849774, ZINC77324643, AKOS016028544, RL02284, SS-3605, PC200055, AJ-122675, AX8253108, 4CH-005467, Cyclohexanecarbonitrile, 1-(2-fluorophenyl)-4-oxo-, J-515222, C13H12FNO,

Complexity	320
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.09g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	217.243g/mol
Monoisotopic Mass	217.09g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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