AG01C5J0

Name: 4-(2,6-difluorophenyl)butanenitrile
Brand: Angene Chemical
SKU: AG01C5J0

1057672-27-1 | 4-(2,6-difluorophenyl)butanenitrile

AG01C5J0

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CAS Number	1057672-27-1
Catalog Number	AG01C5J0
Chemical Name	4-(2,6-difluorophenyl)butanenitrile
IUPAC Name	4-(2,6-difluorophenyl)butanenitrile
InChI	InChI=1S/C10H9F2N/c11-9-5-3-6-10(12)8(9)4-1-2-7-13/h3,5-6H,1-2,4H2
InChI Key	ZGYOXFFRLYVGFO-UHFFFAOYSA-N
MDL Number	MFCD09744527
Molecular Formula	C10H9F2N
Molecular Weight	181.1820
SMILES	FC1=C(CCCC#N)C(F)=CC=C1
Synonyms	4-(2,6-DIFLUOROPHENYL)BUTANENITRILE, 1057672-27-1, ZINC84931540, AKOS006332246,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.07g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	181.186g/mol
Monoisotopic Mass	181.07g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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