Home Nitros Methyl 3-methoxy-4-nitrobenzoate

Methyl 3-methoxy-4-nitrobenzoate

CAS No.:
5081-37-8
Catalog Number:
AG003RSS
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$125
- +
10g
98%
In Stock USA
United States
$200
- +
25g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG003RSS
Chemical Name:
Methyl 3-methoxy-4-nitrobenzoate
CAS Number:
5081-37-8
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
MDL Number:
MFCD00051967
IUPAC Name:
methyl 3-methoxy-4-nitrobenzoate
InChI:
InChI=1S/C9H9NO5/c1-14-8-5-6(9(11)15-2)3-4-7(8)10(12)13/h3-5H,1-2H3
InChI Key:
PVVFEPFLFHDHHK-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)OC)[N+](=O)[O-]
NSC Number:
147082
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.173g/mol
Monoisotopic Mass:
211.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties