Home Nitros 3-Methyl-4-nitrophenylacetic acid methyl ester

3-Methyl-4-nitrophenylacetic acid methyl ester

CAS No.:
156480-27-2
Catalog Number:
AG00HYE0
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$300
- +
5g
96%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00HYE0
Chemical Name:
3-Methyl-4-nitrophenylacetic acid methyl ester
CAS Number:
156480-27-2
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD18399608
IUPAC Name:
methyl 2-(3-methyl-4-nitrophenyl)acetate
InChI:
InChI=1S/C10H11NO4/c1-7-5-8(6-10(12)15-2)3-4-9(7)11(13)14/h3-5H,6H2,1-2H3
InChI Key:
GYUDCBWIPGOCFS-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-]
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:
1.9  
Properties