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Home> Hot Product Listed 2   > 2-chloro-n-(2-propylphenyl)benzamide
2564-06-9 structure

2-chloro-n-(2-propylphenyl)benzamide

Iupac Name:N-benzyl-2-chloroacetamide
CAS No.:2564-06-9
Molecular Weight:183.635
Molecular Formula:C15H15NO5 (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1S/C9H10ClNO/c10-6-9(12)11-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)
InChkey
SRAXAXHQMCQHSH-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C(C=C1)CNC(=O)CCl
Properties
Melting Point
93-96 ºC
Vapour
1.36E-05mmHg at 25°C
Refractive Index
1.539
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:183.635g/mol
  • Molecular Formula:C15H15NO5
  • Compound Is Canonicalized:True
  • XLogP3-AA:1.8
  • Exact Mass:183.045
  • Monoisotopic Mass:183.045
  • Complexity:144
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:29.1A^2
  • Heavy Atom Count:12
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccByIAAEAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHgIQAAAADAPBmEQwAILAAACI AiFSEACCAAAgAAAIiIAIBIhIICKAkRHEIAhglgCIiAcQgAAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-573-85280080
  • Fax:86-573-85285100
  • Tel:+86-0513-87515929
  • Fax:+86-25-84525246
  • Tel:+86 519 8630 5871
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  • Tel:0086-0573-85287218
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  • Tel:+86-571-85395792
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