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26378-73-4 | 1,3-Benzenediol, 2,4,6-trichloro-
CAS No: 26378-73-4 Catalog No: AG002SXW MDL No:
Product Description
Catalog Number:
AG002SXW
Chemical Name:
1,3-Benzenediol, 2,4,6-trichloro-
CAS Number:
26378-73-4
Molecular Formula:
C6H3Cl3O2
Molecular Weight:
213.4458
IUPAC Name:
2,4,6-trichlorobenzene-1,3-diol
InChI:
InChI=1S/C6H3Cl3O2/c7-2-1-3(8)6(11)4(9)5(2)10/h1,10-11H
InChI Key:
NHOATJNESSAPCQ-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c(c(c1O)Cl)O
EC Number:
247-639-3
NSC Number:
36930
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.92g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.438g/mol
Monoisotopic Mass:
211.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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