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8-chloro-1,2,3,4-tetrahydro-1,7-naphthyridine

8-chloro-1,2,3,4-tetrahydro-1,7-naphthyridine

CAS: 1086392-56-4

Formula: C8H9ClN2

SMILES: ClC1=NC=CC2=C1NCCC2

IUPAC: 8-chloro-1,2,3,4-tetrahydro-1,7-naphthyridine

InChI: InChI=1S/C8H9ClN2/c9-8-7-6(3-5-11-8)2-1-4-10-7/h3,5,10H,1-2,4H2

Composition: C (56.98%), H (5.38%), Cl (21.02%), N (16.61%)

Molar Mass: 168.62

Atom Count: 20

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 168.045426
Formal Charge 0
FSP3 0.37
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CTVWMAXLCADLIO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.87
Topological Polar Surface Area 24.92
Polarizability 17.23
Ring Count 2
Rotatable Bond Count 0

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95% <2 Days 1086392-56-4 $171.35-$2,012.50$171.35$228.85$343.85$572.70$2,012.50
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