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8-bromo-6-chloro-3,4-dihydro-2H-1,4-benzoxazine hydrochloride

8-bromo-6-chloro-3,4-dihydro-2H-1,4-benzoxazine hydrochloride

CAS: 1373223-73-4

Formula: C8H8BrCl2NO

SMILES: Cl.ClC1=CC(Br)=C2OCCNC2=C1

IUPAC: 8-bromo-6-chloro-3,4-dihydro-2H-1,4-benzoxazine hydrochloride

InChI: InChI=1S/C8H7BrClNO.ClH/c9-6-3-5(10)4-7-8(6)12-2-1-11-7;/h3-4,11H,1-2H2;1H

Composition: C (33.72%), H (2.83%), Br (28.04%), Cl (24.88%), N (4.92%), O (5.61%)

Molar Mass: 284.96

Atom Count: 21

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 282.916632
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XVTZJIQRUMCLKF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.17
Topological Polar Surface Area 21.26
Polarizability 19.92
Ring Count 2
Rotatable Bond Count 0

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1373223-73-4 $125.35-$1,370.80$125.35$143.75$171.35$227.70$342.70$1,370.80
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