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Home > Other Heterocycles > 7079-91-6
7079-91-6 | Spiro[pyrrolidine-3,9'-[9H]xanthene]
CAS No: 7079-91-6 Catalog No: AG005FUL MDL No:
Product Description
Catalog Number:
AG005FUL
Chemical Name:
Spiro[pyrrolidine-3,9'-[9H]xanthene]
CAS Number:
7079-91-6
Molecular Formula:
C16H15NO
Molecular Weight:
237.2964
IUPAC Name:
spiro[pyrrolidine-3,9'-xanthene]
InChI:
InChI=1S/C16H15NO/c1-3-7-14-12(5-1)16(9-10-17-11-16)13-6-2-4-8-15(13)18-14/h1-8,17H,9-11H2
InChI Key:
YMGYTLOMZJSEAZ-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)Oc1c(C32CNCC3)cccc1
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.115g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.302g/mol
Monoisotopic Mass:
237.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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