AG01C5I8

Name: 3-bromo-1-benzothiophene-5-carbonitrile
Brand: Angene Chemical
SKU: AG01C5I8

1385757-16-3 | 3-bromo-1-benzothiophene-5-carbonitrile

AG01C5I8

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CAS Number	1385757-16-3
Catalog Number	AG01C5I8
Chemical Name	3-bromo-1-benzothiophene-5-carbonitrile
IUPAC Name	3-bromo-1-benzothiophene-5-carbonitrile
InChI	InChI=1S/C9H4BrNS/c10-8-5-12-9-2-1-6(4-11)3-7(8)9/h1-3,5H
InChI Key	PYIDWAIALNWEMI-UHFFFAOYSA-N
MDL Number	MFCD26402428
Molecular Formula	C9H4BrNS
Molecular Weight	238.1038
SMILES	BrC1C2=C(C=CC(=C2)C#N)SC=1
Synonyms	3-bromo-1-benzothiophene-5-carbonitrile, 1385757-16-3, SCHEMBL10053318, AKOS033912596, ZINC204143119, FCH2494925, Benzo[b]thiophene-5-carbonitrile, 3-bromo-, EN300-263723, Z2442102855, 3-bromobenzo[b]thiophene-5-carbonitrile,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	236.925g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	238.102g/mol
Monoisotopic Mass	236.925g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

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