Home Nitros 1-Methyl-2-nitro-3-(trifluoromethyl)benzene

1-Methyl-2-nitro-3-(trifluoromethyl)benzene

CAS No.:
92891-23-1
Catalog Number:
AG00GVXO
Molecular Formula:
C8H6F3NO2
Molecular Weight:
205.1339
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$112
- +
5g
95%
1 week
United States
$257
- +
Product Description
Catalog Number:
AG00GVXO
Chemical Name:
1-Methyl-2-nitro-3-(trifluoromethyl)benzene
CAS Number:
92891-23-1
Molecular Formula:
C8H6F3NO2
Molecular Weight:
205.1339
MDL Number:
MFCD04972920
IUPAC Name:
1-methyl-2-nitro-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H6F3NO2/c1-5-3-2-4-6(8(9,10)11)7(5)12(13)14/h2-4H,1H3
InChI Key:
JTXZOTTYGWMNGR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)cccc1C(F)(F)F
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.035g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.136g/mol
Monoisotopic Mass:
205.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties