Home Carboxys Methyl 1-(2-nitro-4-trifluoromethylphenyl)cyclopropanecarboxylate

Methyl 1-(2-nitro-4-trifluoromethylphenyl)cyclopropanecarboxylate

CAS No.:
951885-67-9
Catalog Number:
AG006PAU
Molecular Formula:
C12H10F3NO4
Molecular Weight:
289.2073
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG006PAU
Chemical Name:
Methyl 1-(2-nitro-4-trifluoromethylphenyl)cyclopropanecarboxylate
CAS Number:
951885-67-9
Molecular Formula:
C12H10F3NO4
Molecular Weight:
289.2073
MDL Number:
MFCD09878310
IUPAC Name:
methyl 1-[2-nitro-4-(trifluoromethyl)phenyl]cyclopropane-1-carboxylate
InChI:
InChI=1S/C12H10F3NO4/c1-20-10(17)11(4-5-11)8-3-2-7(12(13,14)15)6-9(8)16(18)19/h2-3,6H,4-5H2,1H3
InChI Key:
NYRGRYMFQGVYMJ-UHFFFAOYSA-N
SMILES:
COC(=O)C1(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F
Properties
Complexity:
414  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.056g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.21g/mol
Monoisotopic Mass:
289.056g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties