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15054-55-4 | Urea, N-(1-methylpropyl)-N'-phenyl-
CAS No: 15054-55-4 Catalog No: AG001MPU MDL No:
Product Description
Catalog Number:
AG001MPU
Chemical Name:
Urea, N-(1-methylpropyl)-N'-phenyl-
CAS Number:
15054-55-4
Molecular Formula:
C11H16N2O
Molecular Weight:
192.2575
IUPAC Name:
1-butan-2-yl-3-phenylurea
InChI:
InChI=1S/C11H16N2O/c1-3-9(2)12-11(14)13-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H2,12,13,14)
InChI Key:
VFOWJQYAABAIKF-UHFFFAOYSA-N
SMILES:
CCC(NC(=O)Nc1ccccc1)C
NSC Number:
131942
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.262g/mol
Monoisotopic Mass:
192.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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