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87919-25-3 | 1-(4-chlorophenyl)-3-(2-hydroxypropyl)urea
CAS No: 87919-25-3 Catalog No: AG004HKG MDL No:
Product Description
Catalog Number:
AG004HKG
Chemical Name:
1-(4-chlorophenyl)-3-(2-hydroxypropyl)urea
CAS Number:
87919-25-3
Molecular Formula:
C10H13ClN2O2
Molecular Weight:
228.6754
IUPAC Name:
1-(4-chlorophenyl)-3-(2-hydroxypropyl)urea
InChI:
InChI=1S/C10H13ClN2O2/c1-7(14)6-12-10(15)13-9-4-2-8(11)3-5-9/h2-5,7,14H,6H2,1H3,(H2,12,13,15)
InChI Key:
XTEAOBDLYYKDDW-UHFFFAOYSA-N
SMILES:
CC(CNC(=O)Nc1ccc(cc1)Cl)O
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
228.676g/mol
Monoisotopic Mass:
228.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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