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80018-33-3 | Phenol,4-chloro-2-[(2-chlorophenyl)[(1,2-dimethylpropyl)imino]methyl]-
CAS No: 80018-33-3 Catalog No: AG005DRT MDL No:
Product Description
Catalog Number:
AG005DRT
Chemical Name:
Phenol,4-chloro-2-[(2-chlorophenyl)[(1,2-dimethylpropyl)imino]methyl]-
CAS Number:
80018-33-3
Molecular Formula:
C18H19Cl2NO
Molecular Weight:
336.2556
IUPAC Name:
4-chloro-2-[C-(2-chlorophenyl)-N-(3-methylbutan-2-yl)carbonimidoyl]phenol
InChI:
InChI=1S/C18H19Cl2NO/c1-11(2)12(3)21-18(14-6-4-5-7-16(14)20)15-10-13(19)8-9-17(15)22/h4-12,22H,1-3H3
InChI Key:
GVNVXQOAKBLKSA-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C(=NC(C(C)C)C)c1ccccc1Cl)O
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.084g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
336.256g/mol
Monoisotopic Mass:
335.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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