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1353966-58-1 | 2-Chloro-N-(3,4-dichloro-benzyl)-N-ethyl-acetamide
CAS No: 1353966-58-1 Catalog No: AG01F90G MDL No:
Product Description
Catalog Number:
AG01F90G
Chemical Name:
2-Chloro-N-(3,4-dichloro-benzyl)-N-ethyl-acetamide
CAS Number:
1353966-58-1
Molecular Formula:
C11H12Cl3NO
Molecular Weight:
280.5781
IUPAC Name:
2-chloro-N-[(3,4-dichlorophenyl)methyl]-N-ethylacetamide
InChI:
InChI=1S/C11H12Cl3NO/c1-2-15(11(16)6-12)7-8-3-4-9(13)10(14)5-8/h3-5H,2,6-7H2,1H3
InChI Key:
PXIFJCVEAODUCB-UHFFFAOYSA-N
SMILES:
CCN(C(=O)CCl)Cc1ccc(c(c1)Cl)Cl
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.998g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.573g/mol
Monoisotopic Mass:
278.998g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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