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174504-82-6 | Phenol, 2,6-bis[[(2-hydroxyethyl)imino]methyl]-4-methyl-
CAS No: 174504-82-6 Catalog No: AG001ZPS MDL No:
Product Description
Catalog Number:
AG001ZPS
Chemical Name:
Phenol, 2,6-bis[[(2-hydroxyethyl)imino]methyl]-4-methyl-
CAS Number:
174504-82-6
Molecular Formula:
C13H18N2O3
Molecular Weight:
250.2936
IUPAC Name:
2,6-bis(2-hydroxyethyliminomethyl)-4-methylphenol
InChI:
InChI=1S/C13H18N2O3/c1-10-6-11(8-14-2-4-16)13(18)12(7-10)9-15-3-5-17/h6-9,16-18H,2-5H2,1H3
InChI Key:
DRDQUJMHLOOUKI-UHFFFAOYSA-N
SMILES:
OCCN=Cc1cc(C)cc(c1O)C=NCCO
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
250.298g/mol
Monoisotopic Mass:
250.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
85.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Literature
| Title | Journal |
|---|---|
| Self-assembly of mixed-valence Co(II/III) and Ni(II) clusters: azide-bridged 1D single chain coordination polymers comprised of tetranuclear units, tetranuclear Co(II/III) complexes, ferromagnetically coupled azide-bridged tetranuclear, and hexanuclear Ni(II) complexes: synthesis, structural, and magnetic properties. | Dalton transactions (Cambridge, England : 2003) 20090907 |
| Copper coordination polymers based on single-chain or sheet structures involving dinuclear and tetranuclear copper(II) units: synthesis, structures, and magnetostructural correlations. | Inorganic chemistry 20090601 |
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