Home Fluorides 467442-15-5
467442-15-5,MFCD08457661
Catalog No.:AA003IJO
467442-15-5 | 3,5-Difluoro-4-formylbenzonitrile
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1g
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$250.00   $175.00
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5g
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$842.00   $589.00
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10g
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$1,445.00   $1,012.00
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  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003IJO
Chemical Name:
3,5-Difluoro-4-formylbenzonitrile
CAS Number:
467442-15-5
Molecular Formula:
C8H3F2NO
Molecular Weight:
167.1123
MDL Number:
MFCD08457661
IUPAC Name:
3,5-difluoro-4-formylbenzonitrile
InChI:
InChI=1S/C8H3F2NO/c9-7-1-5(3-11)2-8(10)6(7)4-12/h1-2,4H
InChI Key:
GOBXWYWTZCKDBF-UHFFFAOYSA-N
SMILES:
O=Cc1c(F)cc(cc1F)C#N
Properties
Computed Properties
 
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.018g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.115g/mol
Monoisotopic Mass:
167.018g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Synonyms
 
3,5-Difluoro-4-formylbenzonitrile 
467442-15-5 
GOBXWYWTZCKDBF-UHFFFAOYSA-N 
ACT11842 
BCP10049 
ANW-47448 
MFCD08457661 
ZINC38339167 
Benzonitrile,3,5-difluoro-4-formyl- 
AKOS015890063 
AC-3831 
AM62006 
4-Cyano-2,6-difluorobenzaldehyde 
AS01448 
CC-1154 
CM11911 
CS-W000015 
TRA0058711 
3,5-Difluoro-4-formylbenzonitrile, 97% 
AJ-95124 
AK-35264 
AN-12601 
BC686455 
3,5-Difluoro-4-formyl-benzonitrile 
BR-35264 
DS-12572 
SC-31814 
AB0025018 
DB-010050 
RT-019311 
ST2404631 
FT-0657400 
W6401 
S-4127 
Benzonitrile, 3,5-difluoro-4-formyl- 
I01-4856 
C8H3F2NO 
PubChem4188 
ACMC-209xbe 
SCHEMBL603077 
CTK4I9554 
DTXSID30584843 
Literature
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