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88971-77-1 | Urea, N'-[3-(2-chloro-1-methyl-2-phenylethoxy)phenyl]-N,N-dimethyl-
CAS No: 88971-77-1 Catalog No: AG0046V9 MDL No:
Product Description
Catalog Number:
AG0046V9
Chemical Name:
Urea, N'-[3-(2-chloro-1-methyl-2-phenylethoxy)phenyl]-N,N-dimethyl-
CAS Number:
88971-77-1
Molecular Formula:
C18H21ClN2O2
Molecular Weight:
332.8245
IUPAC Name:
3-[3-(1-chloro-1-phenylpropan-2-yl)oxyphenyl]-1,1-dimethylurea
InChI:
InChI=1S/C18H21ClN2O2/c1-13(17(19)14-8-5-4-6-9-14)23-16-11-7-10-15(12-16)20-18(22)21(2)3/h4-13,17H,1-3H3,(H,20,22)
InChI Key:
IVNVCPOHDVMAAX-UHFFFAOYSA-N
SMILES:
CC(C(c1ccccc1)Cl)Oc1cccc(c1)NC(=O)N(C)C
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.129g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.828g/mol
Monoisotopic Mass:
332.129g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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