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175204-49-6 | Benzene, 1,3-dichloro-5-(2,2-diethoxyethoxy)-
CAS No: 175204-49-6 Catalog No: AG0020M3 MDL No:MFCD00052439
Product Description
Catalog Number:
AG0020M3
Chemical Name:
Benzene, 1,3-dichloro-5-(2,2-diethoxyethoxy)-
CAS Number:
175204-49-6
Molecular Formula:
C12H16Cl2O3
Molecular Weight:
279.1596
MDL Number:
MFCD00052439
IUPAC Name:
1,3-dichloro-5-(2,2-diethoxyethoxy)benzene
InChI:
InChI=1S/C12H16Cl2O3/c1-3-15-12(16-4-2)8-17-11-6-9(13)5-10(14)7-11/h5-7,12H,3-4,8H2,1-2H3
InChI Key:
CAKQZUJFZVRSQG-UHFFFAOYSA-N
SMILES:
CCOC(COc1cc(Cl)cc(c1)Cl)OCC
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.048g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.157g/mol
Monoisotopic Mass:
278.048g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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