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67625-58-5 | Isoquinoline, 6-methoxy-7-propoxy- (9CI)
CAS No: 67625-58-5 Catalog No: AG00FTEA MDL No:
Product Description
Catalog Number:
AG00FTEA
Chemical Name:
Isoquinoline, 6-methoxy-7-propoxy- (9CI)
CAS Number:
67625-58-5
IUPAC Name:
6-methoxy-7-propoxyisoquinoline
InChI:
InChI=1S/C13H15NO2/c1-3-6-16-13-8-11-9-14-5-4-10(11)7-12(13)15-2/h4-5,7-9H,3,6H2,1-2H3
InChI Key:
BTHCIRNMPYILEV-UHFFFAOYSA-N
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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