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20335-61-9 | 5-Isoquinolinamine, 1-methyl-
CAS No: 20335-61-9 Catalog No: AG0028UW MDL No:MFCD18260474
Product Description
Catalog Number:
AG0028UW
Chemical Name:
5-Isoquinolinamine, 1-methyl-
CAS Number:
20335-61-9
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
MDL Number:
MFCD18260474
IUPAC Name:
1-methylisoquinolin-5-amine
InChI:
InChI=1S/C10H10N2/c1-7-8-3-2-4-10(11)9(8)5-6-12-7/h2-6H,11H2,1H3
InChI Key:
KBDMNBWTHOKXQA-UHFFFAOYSA-N
SMILES:
Nc1cccc2c1ccnc2C
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.204g/mol
Monoisotopic Mass:
158.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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