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Home > Bromides > 1243389-57-2
1243389-57-2 | 1,2-Benzisoxazole, 6-bromo-3-chloro-
CAS No: 1243389-57-2 Catalog No: AG000LVP MDL No:MFCD12406141
Product Description
Catalog Number:
AG000LVP
Chemical Name:
1,2-Benzisoxazole, 6-bromo-3-chloro-
CAS Number:
1243389-57-2
Molecular Formula:
C7H3BrClNO
Molecular Weight:
232.4618
MDL Number:
MFCD12406141
IUPAC Name:
6-bromo-3-chloro-1,2-benzoxazole
InChI:
InChI=1S/C7H3BrClNO/c8-4-1-2-5-6(3-4)11-10-7(5)9/h1-3H
InChI Key:
OQLUUNXXNDSROP-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)onc2Cl
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.909g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.461g/mol
Monoisotopic Mass:
230.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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