Home Nitros 1,3-Dimethyl-5-(3-nitrophenyl)benzene

1,3-Dimethyl-5-(3-nitrophenyl)benzene

CAS No.:
337973-04-3
Catalog Number:
AG00CLUM
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$300
- +
5g
98%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG00CLUM
Chemical Name:
1,3-Dimethyl-5-(3-nitrophenyl)benzene
CAS Number:
337973-04-3
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
MDL Number:
MFCD21609588
IUPAC Name:
1,3-dimethyl-5-(3-nitrophenyl)benzene
InChI:
InChI=1S/C14H13NO2/c1-10-6-11(2)8-13(7-10)12-4-3-5-14(9-12)15(16)17/h3-9H,1-2H3
InChI Key:
ASEMEDRKYFYIOW-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.095g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties