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259132-20-2 | Phenol, 2,6-dibromo-4-(1,3,4-oxadiazol-2-yl)-
CAS No: 259132-20-2 Catalog No: AG002R0E MDL No:MFCD00275582
Product Description
Catalog Number:
AG002R0E
Chemical Name:
Phenol, 2,6-dibromo-4-(1,3,4-oxadiazol-2-yl)-
CAS Number:
259132-20-2
Molecular Formula:
C8H4Br2N2O2
Molecular Weight:
319.9376
MDL Number:
MFCD00275582
IUPAC Name:
2,6-dibromo-4-(1,3,4-oxadiazol-2-yl)phenol
InChI:
InChI=1S/C8H4Br2N2O2/c9-5-1-4(2-6(10)7(5)13)8-12-11-3-14-8/h1-3,13H
InChI Key:
RICXGHBRPDGRQD-UHFFFAOYSA-N
SMILES:
Oc1c(Br)cc(cc1Br)c1nnco1
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.862g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.94g/mol
Monoisotopic Mass:
317.864g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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