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102433-53-4 | Urea, N-(2-chloroethyl)-N'-(2-methyl-1-phenylpropyl)-
CAS No: 102433-53-4 Catalog No: AG0007GG MDL No:
Product Description
Catalog Number:
AG0007GG
Chemical Name:
Urea, N-(2-chloroethyl)-N'-(2-methyl-1-phenylpropyl)-
CAS Number:
102433-53-4
Molecular Formula:
C13H19ClN2O
Molecular Weight:
254.7558
IUPAC Name:
1-(2-chloroethyl)-3-(2-methyl-1-phenylpropyl)urea
InChI:
InChI=1S/C13H19ClN2O/c1-10(2)12(11-6-4-3-5-7-11)16-13(17)15-9-8-14/h3-7,10,12H,8-9H2,1-2H3,(H2,15,16,17)
InChI Key:
ASGZEECDFQVKNK-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)NC(c1ccccc1)C(C)C
NSC Number:
160191
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.119g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.758g/mol
Monoisotopic Mass:
254.119g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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