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Home > Indoles and Oxindole > 113707-88-3
113707-88-3 | Pyrano[3,2-f]indol-2(8H)-one, 4,6,7-trimethyl-
CAS No: 113707-88-3 Catalog No: AG0009FD MDL No:
Product Description
Catalog Number:
AG0009FD
Chemical Name:
Pyrano[3,2-f]indol-2(8H)-one, 4,6,7-trimethyl-
CAS Number:
113707-88-3
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
IUPAC Name:
4,6,7-trimethyl-8H-pyrano[3,2-f]indol-2-one
InChI:
InChI=1S/C14H13NO2/c1-7-4-14(16)17-13-6-12-11(5-10(7)13)8(2)9(3)15-12/h4-6,15H,1-3H3
InChI Key:
NOTWONLNWCFHEL-UHFFFAOYSA-N
SMILES:
O=c1cc(C)c2c(o1)cc1c(c2)c(c([nH]1)C)C
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.095g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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