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1176603-02-3 | 2-Chloro-N-(2-chloro-benzyl)-N-isopropyl-acetamide
CAS No: 1176603-02-3 Catalog No: AG01F8XW MDL No:
Product Description
Catalog Number:
AG01F8XW
Chemical Name:
2-Chloro-N-(2-chloro-benzyl)-N-isopropyl-acetamide
CAS Number:
1176603-02-3
Molecular Formula:
C12H15Cl2NO
Molecular Weight:
260.1596
IUPAC Name:
2-chloro-N-[(2-chlorophenyl)methyl]-N-propan-2-ylacetamide
InChI:
InChI=1S/C12H15Cl2NO/c1-9(2)15(12(16)7-13)8-10-5-3-4-6-11(10)14/h3-6,9H,7-8H2,1-2H3
InChI Key:
FRSFIWXNWOSYAO-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(C(C)C)Cc1ccccc1Cl
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.158g/mol
Monoisotopic Mass:
259.053g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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