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217479-60-2 | 2,4,6-Trichlorobenzyl alcohol
CAS No: 217479-60-2 Catalog No: AG003FMS MDL No:MFCD03093891
Product Description
Catalog Number:
AG003FMS
Chemical Name:
2,4,6-Trichlorobenzyl alcohol
CAS Number:
217479-60-2
Molecular Formula:
C7H5Cl3O
Molecular Weight:
211.4730
MDL Number:
MFCD03093891
IUPAC Name:
(2,4,6-trichlorophenyl)methanol
InChI:
InChI=1S/C7H5Cl3O/c8-4-1-6(9)5(3-11)7(10)2-4/h1-2,11H,3H2
InChI Key:
WKJWKKDGJLKFER-UHFFFAOYSA-N
SMILES:
OCc1c(Cl)cc(cc1Cl)Cl
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.941g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.466g/mol
Monoisotopic Mass:
209.941g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Catalytic enantioselective sulfinyl transfer using cinchona alkaloid catalysts. | Organic letters 20050428 |
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