AG01BFWE

Name: 3-(1-Benzothiophen-2-yl)-3-oxopropanenitrile
Brand: Angene Chemical
SKU: AG01BFWE

1249556-86-2 | 3-(1-Benzothiophen-2-yl)-3-oxopropanenitrile

AG01BFWE

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CAS Number	1249556-86-2
Catalog Number	AG01BFWE(AGN-PC-0WOTD9)
Chemical Name	3-(1-Benzothiophen-2-yl)-3-oxopropanenitrile
IUPAC Name	3-(1-benzothiophen-2-yl)-3-oxopropanenitrile
InChI	InChI=1S/C11H7NOS/c12-6-5-9(13)11-7-8-3-1-2-4-10(8)14-11/h1-4,7H,5H2
InChI Key	JBFQOOFQRGZKRF-UHFFFAOYSA-N
MDL Number	MFCD14660419
Molecular Formula	C11H7NOS
Molecular Weight	201.2444
SMILES	O=C(C1SC2=C(C=CC=C2)C=1)CC#N
Synonyms	3-(1-benzothiophen-2-yl)-3-oxopropanenitrile, 1249556-86-2, Benzo[b]thiophene-2-propanenitrile, beta-oxo-, SCHEMBL5161323, ZINC42431930, AKOS010666856, FCH4902263, NE24811, BBV-32875611, EN300-188661, Z1913661129,

Complexity	280
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.025g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	201.243g/mol
Monoisotopic Mass	201.025g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	69.1A^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