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Home > Indoles and Oxindole > 84119-67-5
84119-67-5 | 4,7-Epoxy-1H-cyclobut[b]indole(9CI)
CAS No: 84119-67-5 Catalog No: AG004ZJD MDL No:
Product Description
Catalog Number:
AG004ZJD
Chemical Name:
4,7-Epoxy-1H-cyclobut[b]indole(9CI)
CAS Number:
84119-67-5
Molecular Formula:
C10H5NO
Molecular Weight:
155.1528
IUPAC Name:
12-oxa-7-azatetracyclo[7.2.1.02,8.03,6]dodeca-1(11),2,5,7,9-pentaene
InChI:
InChI=1S/C10H5NO/c1-2-6-5(1)9-7-3-4-8(12-7)10(9)11-6/h2-4H,1H2
InChI Key:
YXCBWODDAPFQTO-UHFFFAOYSA-N
SMILES:
c1cc2oc1c1=C3CC=C3N=c21
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.037g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.156g/mol
Monoisotopic Mass:
155.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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