Home Nitros 4-Ethynyl-1-fluoro-2-nitrobenzene

4-Ethynyl-1-fluoro-2-nitrobenzene

CAS No.:
1211528-74-3
Catalog Number:
AG01F5NA
Molecular Formula:
C8H4FNO2
Molecular Weight:
165.1213
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$385
- +
1g
98%
1 week
United States
$746
- +
Product Description
Catalog Number:
AG01F5NA
Chemical Name:
4-Ethynyl-1-fluoro-2-nitrobenzene
CAS Number:
1211528-74-3
Molecular Formula:
C8H4FNO2
Molecular Weight:
165.1213
MDL Number:
MFCD11618093
IUPAC Name:
4-ethynyl-1-fluoro-2-nitrobenzene
InChI:
InChI=1S/C8H4FNO2/c1-2-6-3-4-7(9)8(5-6)10(11)12/h1,3-5H
InChI Key:
NBVVOAKCJRYIAV-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(c(c1)[N+](=O)[O-])F
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.023g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.123g/mol
Monoisotopic Mass:
165.023g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties