AG008OMK

Name: 4-(2-oxoethyl)benzonitrile
Brand: Angene Chemical
SKU: AG008OMK

76113-58-1 | 4-(2-oxoethyl)benzonitrile

AG008OMK

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CAS Number	76113-58-1
Catalog Number	AG008OMK(AGN-PC-0NJIZN)
Chemical Name	4-(2-oxoethyl)benzonitrile
IUPAC Name	4-(2-oxoethyl)benzonitrile
InChI	InChI=1S/C9H7NO/c10-7-9-3-1-8(2-4-9)5-6-11/h1-4,6H,5H2
InChI Key	BTDMXRCUNUVYDT-UHFFFAOYSA-N
MDL Number	MFCD12025076
Molecular Formula	C9H7NO
Molecular Weight	145.1580
SMILES	O=CCC1=CC=C(C#N)C=C1
Synonyms	4-(2-Oxoethyl)benzonitrile, 76113-58-1, Benzonitrile, 4-(2-oxoethyl)-, 4-cyanophenylacetaldehyde, 4-Cyanobenzeneacetaldehyde, SCHEMBL2240175, CTK2G8199, DTXSID10503633, BTDMXRCUNUVYDT-UHFFFAOYSA-N, MFCD12025076, ZINC39251019, AKOS014197297, AJ-99394, AS-50145, DA-03580, FT-0755274,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	145.053g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	145.161g/mol
Monoisotopic Mass	145.053g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

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