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88991-75-7 | Imidodicarbonic diamide, N-(4-hydroxyphenyl)-N'-methyl-
CAS No: 88991-75-7 Catalog No: AG00451Q MDL No:
Product Description
Catalog Number:
AG00451Q
Chemical Name:
Imidodicarbonic diamide, N-(4-hydroxyphenyl)-N'-methyl-
CAS Number:
88991-75-7
Molecular Formula:
C9H11N3O3
Molecular Weight:
209.2019
IUPAC Name:
1-carbamoyl-3-(4-hydroxyphenyl)-1-methylurea
InChI:
InChI=1S/C9H11N3O3/c1-12(8(10)14)9(15)11-6-2-4-7(13)5-3-6/h2-5,13H,1H3,(H2,10,14)(H,11,15)
InChI Key:
ZVBAGSHHGYVMNG-UHFFFAOYSA-N
SMILES:
CN(C(=O)N)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:
209.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
209.205g/mol
Monoisotopic Mass:
209.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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