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

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

CAS: 1160247-95-9

Formula: C12H14BrNO

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

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

InChI: InChI=1S/C12H14BrNO/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

Composition: C (53.75%), H (5.26%), Br (29.80%), N (5.22%), O (5.97%)

Molar Mass: 268.154

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	267.025877
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ZTSRLLMQXDRAAJ-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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