Home Halogens 1,2,4-Oxadiazole, 3-bromo-5-(bromomethyl)-

1,2,4-Oxadiazole, 3-bromo-5-(bromomethyl)-

CAS No.:
121562-13-8
Catalog Number:
AG0015AM
Molecular Formula:
C3H2Br2N2O
Molecular Weight:
241.8688
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Product Description
Catalog Number:
AG0015AM
Chemical Name:
1,2,4-Oxadiazole, 3-bromo-5-(bromomethyl)-
CAS Number:
121562-13-8
Molecular Formula:
C3H2Br2N2O
Molecular Weight:
241.8688
MDL Number:
MFCD06795879
IUPAC Name:
3-bromo-5-(bromomethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C3H2Br2N2O/c4-1-2-6-3(5)7-8-2/h1H2
InChI Key:
TWKMZSDPRBTXPI-UHFFFAOYSA-N
SMILES:
BrCc1onc(n1)Br
Properties
Complexity:
81.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.851g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.87g/mol
Monoisotopic Mass:
239.853g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties