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172547-66-9 | 2-Chloro-N-(2,3-dichloro-benzyl)-acetamide
CAS No: 172547-66-9 Catalog No: AG01FBDR MDL No:
Product Description
Catalog Number:
AG01FBDR
Chemical Name:
2-Chloro-N-(2,3-dichloro-benzyl)-acetamide
CAS Number:
172547-66-9
Molecular Formula:
C9H8Cl3NO
Molecular Weight:
252.5249
IUPAC Name:
2-chloro-N-[(2,3-dichlorophenyl)methyl]acetamide
InChI:
InChI=1S/C9H8Cl3NO/c10-4-8(14)13-5-6-2-1-3-7(11)9(6)12/h1-3H,4-5H2,(H,13,14)
InChI Key:
KHAAHPMRFJVUQZ-UHFFFAOYSA-N
SMILES:
ClCC(=O)NCc1cccc(c1Cl)Cl
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.967g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.519g/mol
Monoisotopic Mass:
250.967g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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