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5-bromo-1,2-dihydrospiro[indole-3,4'-oxane] hydrochloride

5-bromo-1,2-dihydrospiro[indole-3,4'-oxane] hydrochloride

CAS: 1609266-05-8

Formula: C12H15BrClNO

SMILES: Cl.BrC1=CC=C2NCC3(CCOCC3)C2=C1

IUPAC: 5-bromo-1,2-dihydrospiro[indole-3,4'-oxane] hydrochloride

InChI: InChI=1S/C12H14BrNO.ClH/c13-9-1-2-11-10(7-9)12(8-14-11)3-5-15-6-4-12;/h1-2,7,14H,3-6,8H2;1H

Composition: C (47.32%), H (4.96%), Br (26.23%), Cl (11.64%), N (4.60%), O (5.25%)

Molar Mass: 304.61

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 303.002555
Formal Charge 0
FSP3 0.5
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey APPHRLSEYOVFJF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.6
Topological Polar Surface Area 21.26
Polarizability 24.44
Ring Count 3
Rotatable Bond Count 0

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