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Home > Other Heterocycles > 27672-79-3
27672-79-3 | Spiro[indeno[5',4':1,4]cyclobut[1,2-b]oxirene-3(1aH),2'-oxirane] (9CI)
CAS No: 27672-79-3 Catalog No: AG002UEU MDL No:
Product Description
Catalog Number:
AG002UEU
Chemical Name:
Spiro[indeno[5',4':1,4]cyclobut[1,2-b]oxirene-3(1aH),2'-oxirane] (9CI)
CAS Number:
27672-79-3
Molecular Formula:
C12H8O2
Molecular Weight:
184.1907
IUPAC Name:
spiro[12-oxatetracyclo[7.3.0.01,11.04,8]dodeca-4,6,8,10-tetraene-3,2'-oxirane]
InChI:
InChI=1S/C12H8O2/c1-2-7-8(3-1)11(6-13-11)5-12-9(7)4-10(12)14-12/h1-4H,5-6H2
InChI Key:
MFTLURFIROFZCO-UHFFFAOYSA-N
SMILES:
C1=CC2=C3C=C4C3(CC3(C2=C1)OC3)O4
Properties
Complexity:
520
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.052g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.194g/mol
Monoisotopic Mass:
184.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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