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78830-79-2 | Benzene,2,4-dichloro-1-(2,2-diethoxyethoxy)-
CAS No: 78830-79-2 Catalog No: AG005DFL MDL No:
Product Description
Catalog Number:
AG005DFL
Chemical Name:
Benzene,2,4-dichloro-1-(2,2-diethoxyethoxy)-
CAS Number:
78830-79-2
Molecular Formula:
C12H16Cl2O3
Molecular Weight:
279.1596
IUPAC Name:
2,4-dichloro-1-(2,2-diethoxyethoxy)benzene
InChI:
InChI=1S/C12H16Cl2O3/c1-3-15-12(16-4-2)8-17-11-6-5-9(13)7-10(11)14/h5-7,12H,3-4,8H2,1-2H3
InChI Key:
RXEDUFZDANCCBS-UHFFFAOYSA-N
SMILES:
CCOC(COc1ccc(cc1Cl)Cl)OCC
Properties
Complexity:
198
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:
4.3
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