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113470-82-9 | Urea, N-methyl-N-(phenylmethyl)-N'-(2,3,4,5-tetrachlorophenyl)-
CAS No: 113470-82-9 Catalog No: AG0008OS MDL No:
Product Description
Catalog Number:
AG0008OS
Chemical Name:
Urea, N-methyl-N-(phenylmethyl)-N'-(2,3,4,5-tetrachlorophenyl)-
CAS Number:
113470-82-9
Molecular Formula:
C15H12Cl4N2O
Molecular Weight:
378.0806
IUPAC Name:
1-benzyl-1-methyl-3-(2,3,4,5-tetrachlorophenyl)urea
InChI:
InChI=1S/C15H12Cl4N2O/c1-21(8-9-5-3-2-4-6-9)15(22)20-11-7-10(16)12(17)14(19)13(11)18/h2-7H,8H2,1H3,(H,20,22)
InChI Key:
VIYSTHOYIWIVTD-UHFFFAOYSA-N
SMILES:
CN(C(=O)Nc1cc(Cl)c(c(c1Cl)Cl)Cl)Cc1ccccc1
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.967g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
378.074g/mol
Monoisotopic Mass:
375.97g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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