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Home> Encyclopedia > Hot Product Listed 6   > 6H-4a,7-Epoxy-2H-pyrano[3,2-b]oxepin,hexahydro-8-(phenylmethoxy)-, [4aR-(4aa,7a,8a,9ab)]- (9CI)
4914-92-5 structure

6H-4a,7-Epoxy-2H-pyrano[3,2-b]oxepin,hexahydro-8-(phenylmethoxy)-, [4aR-(4aa,7a,8a,9ab)]- (9CI)

CAS No.:4914-92-5
Molecular Weight:98.18606
Molecular Formula:C9H6O3 (isomer)
Names and Identifiers
Synonyms

6H-4a,7-Epoxy-2H-pyrano3,2-boxepin, hexahydro-8-(phenylmethoxy)-, 4aR-(4a.alpha.,7.alpha.,8.alpha.,9a.beta.)-

Inchi
InChI=1S/C7H14/c1-5-7(4)6(2)3/h5-6H,1-4H3/b7-5+
InChkey
PPBWEVVDSRKEIK-FNORWQNLSA-N
Canonical Smiles
CC=C(C)C(C)C
Isomers Smiles
C/C=C(\C)/C(C)C
Properties
Flash Point
229.6°C
Computational chemical data
  • Molecular Weight:98.18606g/mol
  • Molecular Formula:C9H6O3
  • Exact Mass:98.10955
  • Monoisotopic Mass:98.10955
  • Complexity:68.1
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0
  • Heavy Atom Count:7
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:021-67121386 800-988-0390
  • Fax:021-67121385
  • Tel:+49 721 95061-0
  • Fax:+49 721 95061-80
  • Tel:609 656 2440
  • Fax:609 656 2440
  • Tel:800 932 5000
  • Fax:610 436 1761
  • Tel:(852) 23902293
  • Fax:+852 2789 8314
  • Tel:1-631-5046093
  • Fax:1-631-6147828
 
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