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125652-13-3 | Dibenzofuran, 1,3,8-trichloro-6-(1-methylethyl)-
CAS No: 125652-13-3 Catalog No: AG000OA4 MDL No:
Product Description
Catalog Number:
AG000OA4
Chemical Name:
Dibenzofuran, 1,3,8-trichloro-6-(1-methylethyl)-
CAS Number:
125652-13-3
Molecular Formula:
C15H11Cl3O
Molecular Weight:
313.6062
IUPAC Name:
1,3,8-trichloro-6-propan-2-yldibenzofuran
InChI:
InChI=1S/C15H11Cl3O/c1-7(2)10-3-8(16)4-11-14-12(18)5-9(17)6-13(14)19-15(10)11/h3-7H,1-2H3
InChI Key:
FTBOBBMGWSWPNY-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c2c(c1)oc1c2cc(cc1C(C)C)Cl
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.988g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.602g/mol
Monoisotopic Mass:
311.988g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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