Home Nitros 3-Methyl-2-nitrophenylacetic acid

3-Methyl-2-nitrophenylacetic acid

CAS No.:
18710-86-6
Catalog Number:
AG00AKED
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$200
- +
Product Description
Catalog Number:
AG00AKED
Chemical Name:
3-Methyl-2-nitrophenylacetic acid
CAS Number:
18710-86-6
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
MDL Number:
MFCD08276006
IUPAC Name:
2-(3-methyl-2-nitrophenyl)acetic acid
InChI:
InChI=1S/C9H9NO4/c1-6-3-2-4-7(5-8(11)12)9(6)10(13)14/h2-4H,5H2,1H3,(H,11,12)
InChI Key:
MFWFLUXZQHVVHO-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cccc(c1[N+](=O)[O-])C
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.053g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.174g/mol
Monoisotopic Mass:
195.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties