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Home > Indoles and Oxindole > 820964-07-6
820964-07-6 | 1H,3H-Oxazolo[3,4-a]indol-1-one, 3-(1-methylethyl)-
CAS No: 820964-07-6 Catalog No: AG004WZ3 MDL No:
Product Description
Catalog Number:
AG004WZ3
Chemical Name:
1H,3H-Oxazolo[3,4-a]indol-1-one, 3-(1-methylethyl)-
CAS Number:
820964-07-6
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
IUPAC Name:
1-propan-2-yl-1H-[1,3]oxazolo[3,4-a]indol-3-one
InChI:
InChI=1S/C13H13NO2/c1-8(2)12-14-10-6-4-3-5-9(10)7-11(14)13(15)16-12/h3-8,12H,1-2H3
InChI Key:
SLFZTKRWWASBCC-UHFFFAOYSA-N
SMILES:
CC(C1OC(=O)c2n1c1ccccc1c2)C
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.252g/mol
Monoisotopic Mass:
215.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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