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11-bromo-6-chloro-8-oxa-3,5-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaene

11-bromo-6-chloro-8-oxa-3,5-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaene

CAS: 2387695-88-5

Formula: C10H4BrClN2O

SMILES: ClC1=NC=NC2=C1OC1=C2C=CC(Br)=C1

IUPAC: 11-bromo-6-chloro-8-oxa-3,5-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaene

InChI: InChI=1S/C10H4BrClN2O/c11-5-1-2-6-7(3-5)15-9-8(6)13-4-14-10(9)12/h1-4H

Composition: C (42.37%), H (1.42%), Br (28.18%), Cl (12.50%), N (9.88%), O (5.64%)

Molar Mass: 283.51

Atom Count: 19

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 281.919553
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey DTORWSHUUKIRGA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.01
Topological Polar Surface Area 38.92
Polarizability 25.16
Ring Count 3
Rotatable Bond Count 0

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90% <2 Days 2387695-88-5 $51.35-$86.31$51.35$63.37$86.31
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