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89026-27-7 | 3,3',4,4'-tetrachloro-2-methoxybiphenyl
CAS No: 89026-27-7 Catalog No: AG0044C1 MDL No:
Product Description
Catalog Number:
AG0044C1
Chemical Name:
3,3',4,4'-tetrachloro-2-methoxybiphenyl
CAS Number:
89026-27-7
Molecular Formula:
C13H8Cl4O
Molecular Weight:
322.0140
IUPAC Name:
1,2-dichloro-4-(3,4-dichlorophenyl)-3-methoxybenzene
InChI:
InChI=1S/C13H8Cl4O/c1-18-13-8(3-5-10(15)12(13)17)7-2-4-9(14)11(16)6-7/h2-6H,1H3
InChI Key:
UISLBDLTIQJACF-UHFFFAOYSA-N
SMILES:
COc1c(ccc(c1Cl)Cl)c1ccc(c(c1)Cl)Cl
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.93g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.006g/mol
Monoisotopic Mass:
319.933g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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