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88388-03-8 | 3H-Oxazolo[4,3-a]isoquinoline, 1,5,6,10b-tetrahydro-7,8-dimethoxy-
CAS No: 88388-03-8 Catalog No: AG004ILL MDL No:
Product Description
Catalog Number:
AG004ILL
Chemical Name:
3H-Oxazolo[4,3-a]isoquinoline, 1,5,6,10b-tetrahydro-7,8-dimethoxy-
CAS Number:
88388-03-8
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
IUPAC Name:
7,8-dimethoxy-3,5,6,10b-tetrahydro-1H-[1,3]oxazolo[4,3-a]isoquinoline
InChI:
InChI=1S/C13H17NO3/c1-15-12-4-3-9-10(13(12)16-2)5-6-14-8-17-7-11(9)14/h3-4,11H,5-8H2,1-2H3
InChI Key:
FPAIPBPNWRSCOF-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc2c1CCN1C2COC1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.121g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.283g/mol
Monoisotopic Mass:
235.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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