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873854-81-0 | 4H-Pyrrolo[3,4-f]indolizine-4,6(2H)-dione, 8-ethyl-1,3,7-trimethyl-
CAS No: 873854-81-0 Catalog No: AG004K3W MDL No:
Product Description
Catalog Number:
AG004K3W
Chemical Name:
4H-Pyrrolo[3,4-f]indolizine-4,6(2H)-dione, 8-ethyl-1,3,7-trimethyl-
CAS Number:
873854-81-0
Molecular Formula:
C15H16N2O2
Molecular Weight:
256.2997
IUPAC Name:
8-ethyl-6-hydroxy-1,3,7-trimethylpyrrolo[3,4-f]indolizin-4-one
InChI:
InChI=1S/C15H16N2O2/c1-5-10-7(2)14(18)17-12(10)6-11-8(3)16-9(4)13(11)15(17)19/h6,18H,5H2,1-4H3
InChI Key:
CWVOMKMJAJCQIS-UHFFFAOYSA-N
SMILES:
CCc1c(C)c(=O)n2c1cc1c(C)[nH]c(c1c2=O)C
Properties
Complexity:
544
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.121g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.305g/mol
Monoisotopic Mass:
256.121g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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