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18113-14-9 | Phenol, 2,5-dichloro-4-methoxy-
CAS No: 18113-14-9 Catalog No: AG0022P9 MDL No:
Product Description
Catalog Number:
AG0022P9
Chemical Name:
Phenol, 2,5-dichloro-4-methoxy-
CAS Number:
18113-14-9
Molecular Formula:
C7H6Cl2O2
Molecular Weight:
193.0273
IUPAC Name:
2,5-dichloro-4-methoxyphenol
InChI:
InChI=1S/C7H6Cl2O2/c1-11-7-3-4(8)6(10)2-5(7)9/h2-3,10H,1H3
InChI Key:
JXKFAPUUGWQXHX-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)c(cc1Cl)O
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.974g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.023g/mol
Monoisotopic Mass:
191.974g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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