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773088-74-7 | Isoquinoline, 5-(1,3-dioxolan-2-yl)- (9CI)
CAS No: 773088-74-7 Catalog No: AG00GFEU MDL No:
Product Description
Catalog Number:
AG00GFEU
Chemical Name:
Isoquinoline, 5-(1,3-dioxolan-2-yl)- (9CI)
CAS Number:
773088-74-7
IUPAC Name:
5-(1,3-dioxolan-2-yl)isoquinoline
InChI:
InChI=1S/C12H11NO2/c1-2-9-8-13-5-4-10(9)11(3-1)12-14-6-7-15-12/h1-5,8,12H,6-7H2
InChI Key:
AALWENMVRLOMMY-UHFFFAOYSA-N
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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