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35307-24-5 | 3,3,7-trimethyl-3h-furo[2,3-b]pyrano[3,2-f]quinolin-11(7h)-one
CAS No: 35307-24-5 Catalog No: AG007DPX MDL No:
Product Description
Catalog Number:
AG007DPX
Chemical Name:
3,3,7-trimethyl-3h-furo[2,3-b]pyrano[3,2-f]quinolin-11(7h)-one
CAS Number:
35307-24-5
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
IUPAC Name:
5,5,11-trimethyl-6,13-dioxa-11-azatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2(7),3,8,12(16),14-hexaen-17-one
InChI:
InChI=1S/C17H15NO3/c1-17(2)8-6-10-13(21-17)5-4-12-14(10)15(19)11-7-9-20-16(11)18(12)3/h4-9H,1-3H3
InChI Key:
BKILMFHDIHANIX-UHFFFAOYSA-N
SMILES:
O=c1c2c3C=CC(Oc3ccc2n(c2c1cco2)C)(C)C
NSC Number:
103010
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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