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1135-58-6 | Urea, N,N''-1,3-phenylenebis- (9CI)
CAS No: 1135-58-6 Catalog No: AG0008S7 MDL No:
Product Description
Catalog Number:
AG0008S7
Chemical Name:
Urea, N,N''-1,3-phenylenebis- (9CI)
CAS Number:
1135-58-6
Molecular Formula:
C8H10N4O2
Molecular Weight:
194.1906
IUPAC Name:
[3-(carbamoylamino)phenyl]urea
InChI:
InChI=1S/C8H10N4O2/c9-7(13)11-5-2-1-3-6(4-5)12-8(10)14/h1-4H,(H3,9,11,13)(H3,10,12,14)
InChI Key:
KDLXCXLMLIXKAS-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1cccc(c1)NC(=O)N
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.08g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
194.194g/mol
Monoisotopic Mass:
194.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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