Home Fluorides 1007605-44-8
1007605-44-8,MFCD06246886
Catalog No.:AA0002RC
1007605-44-8 | 2,5-Difluoro-4-methoxybenzonitrile
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$29.00   $20.00
- +
5g
97%
in stock  
$72.00   $50.00
- +
25g
97%
in stock  
$215.00   $150.00
- +
100g
97%
in stock  
$715.00   $500.00
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0002RC
Chemical Name:
2,5-Difluoro-4-methoxybenzonitrile
CAS Number:
1007605-44-8
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
MDL Number:
MFCD06246886
IUPAC Name:
2,5-difluoro-4-methoxybenzonitrile
InChI:
InChI=1S/C8H5F2NO/c1-12-8-3-6(9)5(4-11)2-7(8)10/h2-3H,1H3
InChI Key:
WQQDILMHKBTFNR-UHFFFAOYSA-N
SMILES:
COc1cc(F)c(cc1F)C#N
Properties
Computed Properties
 
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.131g/mol
Monoisotopic Mass:
169.034g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
2,5-difluoro-4-methoxybenzonitrile 
1007605-44-8 
CK1055 
FCH920272 
PC1145 
SBB088232 
ZINC16158110 
AKOS005255150 
AS02643 
PS-8721 
Benzonitrile, 2,5-difluoro-4-methoxy- 
2,5-difluoro-4-methoxybenzenecarbonitrile 
MFCD06246886 
AJ-68481 
AK136411 
CJ-15395 
SY025756 
AB0030565 
AX8257979 
DB-031506 
3,6-DIFLUORO-4-METHOXY BENZONITRILE 
4CH-022342 
FT-0715911 
AC1MYK9E 
ST24038743 
X2770 
MFCD06246886 (95%) 
C8H5F2NO 
2,5-difluoro-4-methoxy-benzonitrile 
ACN-050610 
CID3833161 
4-Cyano-2,5-difluoroanisole 
SCHEMBL11963120 
CTK3J9239 
KS-00000YOO 
DTXSID80397061 
ZX-AP004680 
Literature
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