2-butyl-2-ethyldeca...

2-butyl-2-ethyldecanoic acid 5343-56-6

2-butyl-2-ethyldecanoic acid 5343-56-6

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1 Gram

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  • Purity: 99%
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Keywords

2-butyl-2-ethyl-decanoic acid 5343-56-6 C16H32O2

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
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  • ProductionCapacity:10|Kilogram|Month
  • Storage:room temperature
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Details:

Identification and Related Records
【Name】
2-butyl-2-ethyldecanoic acid
【CAS Registry number】
5343-56-6
【Synonyms】
2-BUTYL-2-ETHYLDECANOIC ACID
NSC470
AC1Q5RZD
AC1L56II
2-ethyl-2-butyl-decanoic acid
NSC-470
AR-1D9838
LMFA01020173
【Molecular Formula】
C16H32O2 (Products with the same molecular formula)
【Molecular Weight】
256.4241
【Inchi】
InChI=1/C16H32O2/c1-4-7-9-10-11-12-14-16(6-3,15(17)18)13-8-5-2/h4-14H2,1-3H3,(H,17,18)
【Canonical SMILES】
CCCCCCCCC(CC)(CCCC)C(=O)O
【MOL File】
5343-56-6.mol
Chemical and Physical Properties
【Density】
0.892g/cm3
【Boiling Point】
366.3°C at 760 mmHg
【Refractive Index】
1.453
【Flash Point】
162.8°C
【Computed Properties】
Molecular Weight:256.42408 [g/mol]
Molecular Formula:C16H32O2
XLogP3-AA:6.6
H-Bond Donor:1
H-Bond Acceptor:2
Rotatable Bond Count:12
Exact Mass:256.24023
MonoIsotopic Mass:256.24023
Topological Polar Surface Area:37.3
Heavy Atom Count:18
Formal Charge:0
Complexity:213
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:2
Feature 3D Anion Count:1
Feature 3D Hydrophobe Count:4
Effective Rotor Count:12
Conformer Sampling RMSD:1
CID Conformer Count:335

 

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