AG01C5D8

Name: 3-Oxo-2-phenyl-3-(thiophen-3-yl)propanenitrile
Brand: Angene Chemical
SKU: AG01C5D8

1094395-94-4 | 3-Oxo-2-phenyl-3-(thiophen-3-yl)propanenitrile

AG01C5D8

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CAS Number	1094395-94-4
Catalog Number	AG01C5D8
Chemical Name	3-Oxo-2-phenyl-3-(thiophen-3-yl)propanenitrile
IUPAC Name	3-oxo-2-phenyl-3-thiophen-3-ylpropanenitrile
InChI	InChI=1S/C13H9NOS/c14-8-12(10-4-2-1-3-5-10)13(15)11-6-7-16-9-11/h1-7,9,12H
InChI Key	OGBQTTVGAYEJQA-UHFFFAOYSA-N
MDL Number	MFCD11208552
Molecular Formula	C13H9NOS
Molecular Weight	227.2817
SMILES	O=C(C1=CSC=C1)C(C1=CC=CC=C1)C#N
Synonyms	3-oxo-2-phenyl-3-(thiophen-3-yl)propanenitrile, 1094395-94-4, AKOS009332164, EN300-263293, Z649435498,

Complexity	300
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.04g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	227.281g/mol
Monoisotopic Mass	227.04g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	69.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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