Home Nitros Benzenamine, 2-methyl-5-nitro-, hydrate (1:1)

Benzenamine, 2-methyl-5-nitro-, hydrate (1:1)

CAS No.:
304851-86-3
Catalog Number:
AG0030A8
Molecular Formula:
C7H10N2O3
Molecular Weight:
170.1659
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG0030A8
Chemical Name:
Benzenamine, 2-methyl-5-nitro-, hydrate (1:1)
CAS Number:
304851-86-3
Molecular Formula:
C7H10N2O3
Molecular Weight:
170.1659
MDL Number:
MFCD00007741
IUPAC Name:
2-methyl-5-nitroaniline;hydrate
InChI:
InChI=1S/C7H8N2O2.H2O/c1-5-2-3-6(9(10)11)4-7(5)8;/h2-4H,8H2,1H3;1H2
InChI Key:
ITFWBNDIWBWVBM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1)N)C.O
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.168g/mol
Monoisotopic Mass:
170.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties