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836604-51-4 | Ethanediamide, N-(2-hydroxyethyl)-N'-(4-hydroxyphenyl)-
CAS No: 836604-51-4 Catalog No: AG004Y29 MDL No:
Product Description
Catalog Number:
AG004Y29
Chemical Name:
Ethanediamide, N-(2-hydroxyethyl)-N'-(4-hydroxyphenyl)-
CAS Number:
836604-51-4
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
IUPAC Name:
N-(2-hydroxyethyl)-N'-(4-hydroxyphenyl)oxamide
InChI:
InChI=1S/C10H12N2O4/c13-6-5-11-9(15)10(16)12-7-1-3-8(14)4-2-7/h1-4,13-14H,5-6H2,(H,11,15)(H,12,16)
InChI Key:
KXIZFLVMGLPPED-UHFFFAOYSA-N
SMILES:
OCCNC(=O)C(=O)Nc1ccc(cc1)O
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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