Home Other Building Blocks 2-Nitro-5-(trifluoromethyl)benzyl alcohol

2-Nitro-5-(trifluoromethyl)benzyl alcohol

CAS No.:
1227604-33-2
Catalog Number:
AG000JEQ
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$149
- +
1g
95%
1 week
United States
$317
- +
5g
95%
1 week
United States
$874
- +
Product Description
Catalog Number:
AG000JEQ
Chemical Name:
2-Nitro-5-(trifluoromethyl)benzyl alcohol
CAS Number:
1227604-33-2
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
MDL Number:
MFCD16606347
IUPAC Name:
[2-nitro-5-(trifluoromethyl)phenyl]methanol
InChI:
InChI=1S/C8H6F3NO3/c9-8(10,11)6-1-2-7(12(14)15)5(3-6)4-13/h1-3,13H,4H2
InChI Key:
GQOSINQFQQRBFR-UHFFFAOYSA-N
SMILES:
OCc1cc(ccc1[N+](=O)[O-])C(F)(F)F
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.03g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.135g/mol
Monoisotopic Mass:
221.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties