AG00BIFJ

Name: 2-(3-Bromophenyl)-3-oxobutanenitrile
Brand: Angene Chemical
SKU: AG00BIFJ

30118-02-6 | 2-(3-Bromophenyl)-3-oxobutanenitrile

AG00BIFJ

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CAS Number	30118-02-6
Catalog Number	AG00BIFJ(AGN-PC-0R5FKE)
Chemical Name	2-(3-Bromophenyl)-3-oxobutanenitrile
IUPAC Name	2-(3-bromophenyl)-3-oxobutanenitrile
InChI	InChI=1S/C10H8BrNO/c1-7(13)10(6-12)8-3-2-4-9(11)5-8/h2-5,10H,1H3
InChI Key	YNSRFDBOLZEERT-UHFFFAOYSA-N
MDL Number	MFCD12138972
Molecular Formula	C10H8BrNO
Molecular Weight	238.0806
SMILES	CC(C(C1=CC(Br)=CC=C1)C#N)=O
Synonyms	2-(3-bromophenyl)-3-oxobutanenitrile, 30118-02-6, 2-(3-bromo-phenyl)-acetoacetonitrile, SCHEMBL4175399, V5012, C10H8BrNO,

Complexity	243
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	236.979g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	238.084g/mol
Monoisotopic Mass	236.979g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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