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

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

CAS: 645416-98-4

Formula: C13H16BrN

SMILES: BrC1=CC2=C(NCC22CCCCC2)C=C1

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

InChI: InChI=1S/C13H16BrN/c14-10-4-5-12-11(8-10)13(9-15-12)6-2-1-3-7-13/h4-5,8,15H,1-3,6-7,9H2

Composition: C (58.66%), H (6.06%), Br (30.02%), N (5.26%)

Molar Mass: 266.182

Atom Count: 31

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 265.046613
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey IZEPVDFSBBDDPJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.05
Topological Polar Surface Area 12.03
Polarizability 25.53
Ring Count 3
Rotatable Bond Count 0

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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 645416-98-4 $353.81-$3,803.44$353.81$619.16$1,267.81$3,803.44
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