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82239-20-1 | Benzene, 1,2-dichloro-3-(4-nitrophenoxy)-
CAS No: 82239-20-1 Catalog No: AG0056DG MDL No:
Product Description
Catalog Number:
AG0056DG
Chemical Name:
Benzene, 1,2-dichloro-3-(4-nitrophenoxy)-
CAS Number:
82239-20-1
Molecular Formula:
C12H7Cl2NO3
Molecular Weight:
284.0949
IUPAC Name:
1,2-dichloro-3-(4-nitrophenoxy)benzene
InChI:
InChI=1S/C12H7Cl2NO3/c13-10-2-1-3-11(12(10)14)18-9-6-4-8(5-7-9)15(16)17/h1-7H
InChI Key:
AZUUTFWNNMYVBH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)Oc1cccc(c1Cl)Cl
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.98g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.092g/mol
Monoisotopic Mass:
282.98g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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