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102433-70-5 | Urea, N-(2-chloroethyl)-N'-(2,3,5,6-tetramethylphenyl)-
CAS No: 102433-70-5 Catalog No: AG0007HK MDL No:
Product Description
Catalog Number:
AG0007HK
Chemical Name:
Urea, N-(2-chloroethyl)-N'-(2,3,5,6-tetramethylphenyl)-
CAS Number:
102433-70-5
Molecular Formula:
C13H19ClN2O
Molecular Weight:
254.7558
IUPAC Name:
1-(2-chloroethyl)-3-(2,3,5,6-tetramethylphenyl)urea
InChI:
InChI=1S/C13H19ClN2O/c1-8-7-9(2)11(4)12(10(8)3)16-13(17)15-6-5-14/h7H,5-6H2,1-4H3,(H2,15,16,17)
InChI Key:
NPOTVBZBUUIREW-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)Nc1c(C)c(C)cc(c1C)C
NSC Number:
162078
Properties
Complexity:
246
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:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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