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157683-72-2 | Benzene, 1,3-dichloro-2-(4-chlorophenoxy)-
CAS No: 157683-72-2 Catalog No: AG001PMF MDL No:
Product Description
Catalog Number:
AG001PMF
Chemical Name:
Benzene, 1,3-dichloro-2-(4-chlorophenoxy)-
CAS Number:
157683-72-2
Molecular Formula:
C12H7Cl3O
Molecular Weight:
273.5424
IUPAC Name:
1,3-dichloro-2-(4-chlorophenoxy)benzene
InChI:
InChI=1S/C12H7Cl3O/c13-8-4-6-9(7-5-8)16-12-10(14)2-1-3-11(12)15/h1-7H
InChI Key:
ZMRFCSWFCKICQE-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1Oc1ccc(cc1)Cl)Cl
UNII:
29TYC66YSG
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.956g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.537g/mol
Monoisotopic Mass:
271.956g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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