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1260759-47-4 | 5-Isoquinolinamine, 1-iodo-
CAS No: 1260759-47-4 Catalog No: AG000R4J MDL No:MFCD12923109
Product Description
Catalog Number:
AG000R4J
Chemical Name:
5-Isoquinolinamine, 1-iodo-
CAS Number:
1260759-47-4
Molecular Formula:
C9H7IN2
Molecular Weight:
270.0697
MDL Number:
MFCD12923109
IUPAC Name:
1-iodoisoquinolin-5-amine
InChI:
InChI=1S/C9H7IN2/c10-9-7-2-1-3-8(11)6(7)4-5-12-9/h1-5H,11H2
InChI Key:
SYOJRWLCEOHSFI-UHFFFAOYSA-N
SMILES:
Nc1cccc2c1ccnc2I
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.965g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.073g/mol
Monoisotopic Mass:
269.965g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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