2-chloro-N-(2-methy...

2-chloro-N-(2-methylpropyl)benzamide 5397-17-1

2-chloro-N-(2-methylpropyl)benzamide 5397-17-1

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1 Gram

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  • Min.Order :1 Gram
  • Purity: 99%
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2-chloro-N-(2-methylpropyl)benzamide 5397-17-1 98%

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:100|Kilogram|Month
  • Storage:room temperature
  • Transportation:as requested

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Details:

【Name】
2-chloro-N-(2-methylpropyl)benzamide
【Iupac name】
2-chloro-N-(2-methylpropyl)benzamide
【CAS Registry number】
5397-17-1
【Synonyms】
2-Chloro-N-isobutylbenzamide
benzamide, 2-chloro-N-(2-methylpropyl)-
【Molecular Formula】
C11H14ClNO (Products with the same molecular formula)
【Molecular Weight】
211.688
【Inchi】
InChI=1/C11H14ClNO/c1-8(2)7-13-11(14)9-5-3-4-6-10(9)12/h3-6,8H,7H2,1-2H3,(H,13,14)
【Canonical SMILES】
CC(C)CNC(=O)C1=CC=CC=C1Cl
【MOL File】
5397-17-1.mol
Chemical and Physical Properties
【Density】
1.104g/cm3
【Boiling Point】
330.4°C at 760 mmHg
【Refractive Index】
1.523
【Flash Point】
153.6°C
【Computed Properties】
Molecular Weight:211.68796 [g/mol]
Molecular Formula:C11H14ClNO
XLogP3:2.2
H-Bond Donor:1
H-Bond Acceptor:1
Rotatable Bond Count:3
Tautomer Count:2
Exact Mass:211.076392
MonoIsotopic Mass:211.076392
Topological Polar Surface Area:29.1
Heavy Atom Count:14
Formal Charge:0
Complexity:194
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:1
Effective Rotor Count:4
Conformer Sampling RMSD:0.6
CID Conformer Count:8

 

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