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89680-67-1 | Urea, N,N'-bis(hydroxyphenyl)-
CAS No: 89680-67-1 Catalog No: AG0044I0 MDL No:
Product Description
Catalog Number:
AG0044I0
Chemical Name:
Urea, N,N'-bis(hydroxyphenyl)-
CAS Number:
89680-67-1
Molecular Formula:
C13H12N2O3
Molecular Weight:
244.2460
IUPAC Name:
1,3-bis(2-hydroxyphenyl)urea
InChI:
InChI=1S/C13H12N2O3/c16-11-7-3-1-5-9(11)14-13(18)15-10-6-2-4-8-12(10)17/h1-8,16-17H,(H2,14,15,18)
InChI Key:
YGOBLLDZSBDISH-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1O)Nc1ccccc1O
NSC Number:
48660
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
244.25g/mol
Monoisotopic Mass:
244.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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