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83142-86-3 | Phenol, 2,6-bis[(5-chloro-2-hydroxyphenyl)methyl]-
CAS No: 83142-86-3 Catalog No: AG0050EH MDL No:
Product Description
Catalog Number:
AG0050EH
Chemical Name:
Phenol, 2,6-bis[(5-chloro-2-hydroxyphenyl)methyl]-
CAS Number:
83142-86-3
Molecular Formula:
C20H16Cl2O3
Molecular Weight:
375.2452
IUPAC Name:
2,6-bis[(5-chloro-2-hydroxyphenyl)methyl]phenol
InChI:
InChI=1S/C20H16Cl2O3/c21-16-4-6-18(23)14(10-16)8-12-2-1-3-13(20(12)25)9-15-11-17(22)5-7-19(15)24/h1-7,10-11,23-25H,8-9H2
InChI Key:
KHRQPCXNZAACGN-UHFFFAOYSA-N
SMILES:
Oc1c(cccc1Cc1cc(Cl)ccc1O)Cc1cc(Cl)ccc1O
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.048g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
375.245g/mol
Monoisotopic Mass:
374.048g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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