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75717-50-9 | Ethanone,2-chloro-1-(4-chloro-2-hydroxyphenyl)-
CAS No: 75717-50-9 Catalog No: AG005IR0 MDL No:
Product Description
Catalog Number:
AG005IR0
Chemical Name:
Ethanone,2-chloro-1-(4-chloro-2-hydroxyphenyl)-
CAS Number:
75717-50-9
Molecular Formula:
C8H6Cl2O2
Molecular Weight:
205.0380
IUPAC Name:
2-chloro-1-(4-chloro-2-hydroxyphenyl)ethanone
InChI:
InChI=1S/C8H6Cl2O2/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,11H,4H2
InChI Key:
JZJONDYFQMOULM-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1ccc(cc1O)Cl
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.974g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.034g/mol
Monoisotopic Mass:
203.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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