Home Nitros Ethyl 3-methyl-2-nitrobenzoate

Ethyl 3-methyl-2-nitrobenzoate

CAS No.:
54064-39-0
Catalog Number:
AG00E3ZU
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$107
- +
5g
98%
1 week
United States
$246
- +
25g
98%
1 week
United States
$802
- +
Product Description
Catalog Number:
AG00E3ZU
Chemical Name:
Ethyl 3-methyl-2-nitrobenzoate
CAS Number:
54064-39-0
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD11111006
IUPAC Name:
ethyl 3-methyl-2-nitrobenzoate
InChI:
InChI=1S/C10H11NO4/c1-3-15-10(12)8-6-4-5-7(2)9(8)11(13)14/h4-6H,3H2,1-2H3
InChI Key:
GORJIFRUPPQKPQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1[N+](=O)[O-])C
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties