AG007QVQ

Name: 3-Benzoylphenylacetonitrile
Brand: Angene Chemical
SKU: AG007QVQ

21288-34-6 | 3-Benzoylphenylacetonitrile

AG007QVQ

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CAS Number	21288-34-6
Catalog Number	AG007QVQ(AGN-PC-0JLXP9)
Chemical Name	3-Benzoylphenylacetonitrile
EC Number	244-315-3
IUPAC Name	2-(3-benzoylphenyl)acetonitrile
InChI	InChI=1S/C15H11NO/c16-10-9-12-5-4-8-14(11-12)15(17)13-6-2-1-3-7-13/h1-8,11H,9H2
InChI Key	MHKMCTCMEDUINO-UHFFFAOYSA-N
MDL Number	MFCD00045624
Molecular Formula	C15H11NO
Molecular Weight	221.2539
SMILES	O=C(c1ccccc1)c2cccc(CC#N)c2
UNII	Y444TA4HYW
Synonyms	3-Benzoylphenylacetonitrile, 21288-34-6, (3-Benzoylphenyl)acetonitrile, 2-(3-benzoylphenyl)acetonitrile, (3-Benzoylphenyl)ethanenitrile, UNII-Y444TA4HYW, Y444TA4HYW, zlchem 867, Ketoprofen Impurity I, AC1L3GMO, (m-benzoylphenyl)acetonitrile, 3-BENZOYLBENZYLCYANIDE, SCHEMBL6158425, Benzeneacetonitrile, 3-benzoyl-, D-Camphor-10-sulfonyl-chloride, CTK8F1766, DTXSID50175555, ZLD0328, MHKMCTCMEDUINO-UHFFFAOYSA-N, ACT05710, ZINC2507897, EINECS 244-315-3, MFCD00045624, AKOS022506470, ACN-048859, RU-5029, VZ31314, AS-17388, U882, 2-[3-(phenylcarbonyl)phenyl]ethanenitrile, TL8001768, FT-0084420, FT-0638105, 288B346, A815247, S14-0599, C15H11NO, BENZOPHENONE-3-PROPIONITRILE, CID88857, (1S)-Camphor-10-sulfonic acid chloride,

Complexity	308
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.084g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	221.259g/mol
Monoisotopic Mass	221.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	40.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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