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22544-04-3 | 2,4-Dichloro-1-(2-chloro-4-nitrophenoxy)benzene
CAS No: 22544-04-3 Catalog No: AG003GU4 MDL No:MFCD00204155
Product Description
Catalog Number:
AG003GU4
Chemical Name:
2,4-Dichloro-1-(2-chloro-4-nitrophenoxy)benzene
CAS Number:
22544-04-3
Molecular Formula:
C12H6Cl3NO3
Molecular Weight:
318.5399
MDL Number:
MFCD00204155
IUPAC Name:
2-chloro-1-(2,4-dichlorophenoxy)-4-nitrobenzene
InChI:
InChI=1S/C12H6Cl3NO3/c13-7-1-3-11(9(14)5-7)19-12-4-2-8(16(17)18)6-10(12)15/h1-6H
InChI Key:
SDEVFRSHCRPEJZ-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)Oc1ccc(cc1Cl)[N+](=O)[O-]
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.941g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.534g/mol
Monoisotopic Mass:
316.941g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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