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145522-01-6 | Phenol, 2,2'-[(2-hydroxy-1,3-propanediyl)bis(iminomethylene)]bis-
CAS No: 145522-01-6 Catalog No: AG001D5Q MDL No:
Product Description
Catalog Number:
AG001D5Q
Chemical Name:
Phenol, 2,2'-[(2-hydroxy-1,3-propanediyl)bis(iminomethylene)]bis-
CAS Number:
145522-01-6
Molecular Formula:
C17H22N2O3
Molecular Weight:
302.3682
IUPAC Name:
2-[[[2-hydroxy-3-[(2-hydroxyphenyl)methylamino]propyl]amino]methyl]phenol
InChI:
InChI=1S/C17H22N2O3/c20-15(11-18-9-13-5-1-3-7-16(13)21)12-19-10-14-6-2-4-8-17(14)22/h1-8,15,18-22H,9-12H2
InChI Key:
FZSSZHZLZZEIPT-UHFFFAOYSA-N
SMILES:
OC(CNCc1ccccc1O)CNCc1ccccc1O
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.163g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
302.374g/mol
Monoisotopic Mass:
302.163g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
84.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Controlled copper-mediated chlorination of phenol rings under mild conditions. | Inorganic chemistry 20070611 |
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