2-(acetylamino)tetr...

2-(acetylamino)tetradecanoic acid 5440-51-7

2-(acetylamino)tetradecanoic acid 5440-51-7

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1 Gram

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  • Min.Order :1 Gram
  • Purity: 99%
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Keywords

2-acetamidotetradecanoic acid 5440-51-7 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-(acetylamino)tetradecanoic acid
【CAS Registry number】
5440-51-7
【Synonyms】
2-(acetylamino)tetradecanoic acid
NSC20177
AC1L5FVD
AC1Q5KZP
2-acetamidotetradecanoic acid
AR-1C8404
NSC-20177
【Molecular Formula】
C16H31NO3 (Products with the same molecular formula)
【Molecular Weight】
285.4222
【Inchi】
InChI=1/C16H31NO3/c1-3-4-5-6-7-8-9-10-11-12-13-15(16(19)20)17-14(2)18/h15H,3-13H2,1-2H3,(H,17,18)(H,19,20)
【Canonical SMILES】
CCCCCCCCCCCCC(C(=O)O)NC(=O)C
【MOL File】
5440-51-7.mol
Chemical and Physical Properties
【Density】
0.972g/cm3
【Boiling Point】
463.7°C at 760 mmHg
【Refractive Index】
1.466
【Flash Point】
234.2°C
【Computed Properties】
Molecular Weight:285.42224 [g/mol]
Molecular Formula:C16H31NO3
XLogP3-AA:5.3
H-Bond Donor:2
H-Bond Acceptor:3
Rotatable Bond Count:13
Tautomer Count:2
Exact Mass:285.230394
MonoIsotopic Mass:285.230394
Topological Polar Surface Area:66.4
Heavy Atom Count:20
Formal Charge:0
Complexity:266
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:3
Feature 3D Donor Count:1
Feature 3D Anion Count:1
Feature 3D Hydrophobe Count:1
Effective Rotor Count:14
Conformer Sampling RMSD:1.4
CID Conformer Count:58

 

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