3-bromo-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride

3-bromo-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride

CAS: 1159010-96-4

Formula: C8H10BrClN2

SMILES: Cl.BrC1=CC2=C(CCNC2)N=C1

IUPAC: 3-bromo-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride

InChI: InChI=1S/C8H9BrN2.ClH/c9-7-3-6-4-10-2-1-8(6)11-5-7;/h3,5,10H,1-2,4H2;1H

Composition: C (38.51%), H (4.04%), Br (32.02%), Cl (14.21%), N (11.23%)

Molar Mass: 249.54

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	247.971589
Formal Charge	0
FSP3	0.37
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UYPMMDKARAQFRH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.5
Topological Polar Surface Area	24.92
Polarizability	18.46
Ring Count	2
Rotatable Bond Count	0

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