Home Other Building Blocks 3-(BROMOMETHYL)-1,2,5-OXADIAZOLE

3-(BROMOMETHYL)-1,2,5-OXADIAZOLE

CAS No.:
849415-41-4
Catalog Number:
AG01DSUK
Molecular Formula:
C3H3BrN2O
Molecular Weight:
162.9727
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Product Description
Catalog Number:
AG01DSUK
Chemical Name:
3-(BROMOMETHYL)-1,2,5-OXADIAZOLE
CAS Number:
849415-41-4
Molecular Formula:
C3H3BrN2O
Molecular Weight:
162.9727
MDL Number:
MFCD23704083
IUPAC Name:
3-(bromomethyl)-1,2,5-oxadiazole
InChI:
InChI=1S/C3H3BrN2O/c4-1-3-2-5-7-6-3/h2H,1H2
InChI Key:
ZLSXOKCLGJHIKN-UHFFFAOYSA-N
SMILES:
BrCc1cnon1
Properties
Complexity:
60.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.943g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.974g/mol
Monoisotopic Mass:
161.943g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties