Home Fluorides 101048-76-4
101048-76-4,MFCD06738989
Catalog No.:AA0003K1
101048-76-4 | 2-Fluoro-4-formylbenzonitrile
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$22.00   $15.00
- +
1g
97%
in stock  
$52.00   $36.00
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5g
97%
in stock  
$178.00   $124.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0003K1
Chemical Name:
2-Fluoro-4-formylbenzonitrile
CAS Number:
101048-76-4
Molecular Formula:
C8H4FNO
Molecular Weight:
149.1219
MDL Number:
MFCD06738989
IUPAC Name:
2-fluoro-4-formylbenzonitrile
InChI:
InChI=1S/C8H4FNO/c9-8-3-6(5-11)1-2-7(8)4-10/h1-3,5H
InChI Key:
MYUPCEIJNBAAFL-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)C#N
Properties
Computed Properties
 
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.028g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.124g/mol
Monoisotopic Mass:
149.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Synonyms
 
2-Fluoro-4-formylbenzonitrile 
101048-76-4 
CTK3J9498 
Benzonitrile,2-fluoro-4-formyl- 
DTXSID10458977 
MYUPCEIJNBAAFL-UHFFFAOYSA-N 
ACT06597 
KS-00000JY6 
4-Cyano-3-fluorobenzaldehyde, 96% 
ANW-44458 
CL8921 
MFCD06738989 
4-Cyano-3-fluorobenzaldehyde 
SBB055304 
ZINC12336555 
AKOS005072204 
AB28328 
AM84211 
DB-0608 
RP09970 
RTR-000310 
AC-28645 
AJ-60968 
2-fluoro-4-formyl-benzonitrile 
AK-30947 
SC-02224 
SY026547 
AB0036320 
ST2404408 
TR-000310 
4CH-018374 
CS-0034821 
F1112 
FT-0082870 
3-Fluoro-4-Cyanobenzaldehyde 
FT-0651250 
Y3515 
MFCD06738989 (95%) 
A19520 
Q-8520 
J-509398 
I01-15154 
C8H4FNO 
ACN-044876 
CID11217339 
2-Fluoro-4-formylbenzenecarbonitrile 
Benzonitrile, 2-fluoro-4-formyl- (9CI) 
BENZONITRILE, 2-FLUORO-4-FORMYL- 
ACMC-209v0c 
fluoroformylbenzenecarbonitrile 
SCHEMBL923510 
Literature
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