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3-methylisoquinolin-5-amine

3-methylisoquinolin-5-amine

CAS: 54410-17-2

Formula: C10H10N2

SMILES: CC1=CC2=C(N)C=CC=C2C=N1

IUPAC: 3-methylisoquinolin-5-amine

InChI: InChI=1S/C10H10N2/c1-7-5-9-8(6-12-7)3-2-4-10(9)11/h2-6H,11H2,1H3

Composition: C (75.92%), H (6.37%), N (17.71%)

Molar Mass: 158.204

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 158.08439833
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZQLKOMXEZYQQBJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.64
Topological Polar Surface Area 38.91
Polarizability 19.92
Ring Count 2
Rotatable Bond Count 0

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 54410-17-2 $51.35-$442.46$51.35$63.37$86.31$442.46
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