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1053656-01-1 | 1-(isoquinolin-5-yl)propan-1-one
CAS No: 1053656-01-1 Catalog No: AG008TZL MDL No:MFCD10699239
Product Description
Catalog Number:
AG008TZL
Chemical Name:
1-(isoquinolin-5-yl)propan-1-one
CAS Number:
1053656-01-1
MDL Number:
MFCD10699239
IUPAC Name:
1-isoquinolin-5-ylpropan-1-one
InChI:
InChI=1S/C12H11NO/c1-2-12(14)11-5-3-4-9-8-13-7-6-10(9)11/h3-8H,2H2,1H3
InChI Key:
KXAHLCOLHKNWHG-UHFFFAOYSA-N
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.226g/mol
Monoisotopic Mass:
185.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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