2,3-diphenyloxirane...

2,3-diphenyloxirane-2-carboxylic acid 5449-25-2

2,3-diphenyloxirane-2-carboxylic acid 5449-25-2

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1 Kilogram

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  • Min.Order :1 Kilogram
  • Purity: 99%
  • Payment Terms : L/C,T/T,

Keywords

2,3-diphenyloxirane-2-carboxylic acid 5449-25-2 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】
2,3-diphenyloxirane-2-carboxylic acid
【CAS Registry number】
5449-25-2
【Synonyms】
2,3-diphenyloxirane-2-carboxylic acid
5449-25-2
NSC16294
AC1L5EJO
AC1Q5UKE
AR-1D2763
NSC-16294
NSC167096
NSC167108
NSC-167096
NSC-167108
18521-13-6
53884-88-1
【Molecular Formula】
C15H12O3 (Products with the same molecular formula)
【Molecular Weight】
240.25398
【Inchi】
InChI=1S/C15H12O3/c16-14(17)15(12-9-5-2-6-10-12)13(18-15)11-7-3-1-4-8-11/h1-10,13H,(H,16,17)
【InChIKey】
VTCBMUQQGHEZCK-UHFFFAOYSA-N
【Canonical SMILES】
C1=CC=C(C=C1)C2C(O2)(C3=CC=CC=C3)C(=O)O
Chemical and Physical Properties
【Density】
1.31g/cm3
【Boiling Point】
415.5°Cat760mmHg
【Flash Point】
160°C
【Computed Properties】
Molecular Weight:240.25398 [g/mol]
Molecular Formula:C15H12O3
XLogP3-AA:2.5
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:3
Exact Mass:240.078644
MonoIsotopic Mass:240.078644
Topological Polar Surface Area:49.8
Heavy Atom Count:18
Formal Charge:0
Complexity:316
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:3
Feature 3D Anion Count:1
Feature 3D Ring Count:2
Effective Rotor Count:3.6
Conformer Sampling RMSD:0.6
CID Conformer Count:18

 

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