Home Halogens 2-(6-bromonaphthalen-2-yl)-5-(chloromethyl)-1,3,4-oxadiazole

2-(6-bromonaphthalen-2-yl)-5-(chloromethyl)-1,3,4-oxadiazole

CAS No.:
1550183-92-0
Catalog Number:
AG01C0JP
Molecular Formula:
C13H8BrClN2O
Molecular Weight:
323.5724
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Product Description
Catalog Number:
AG01C0JP
Chemical Name:
2-(6-bromonaphthalen-2-yl)-5-(chloromethyl)-1,3,4-oxadiazole
CAS Number:
1550183-92-0
Molecular Formula:
C13H8BrClN2O
Molecular Weight:
323.5724
MDL Number:
MFCD25681169
IUPAC Name:
2-(6-bromonaphthalen-2-yl)-5-(chloromethyl)-1,3,4-oxadiazole
InChI:
InChI=1S/C13H8BrClN2O/c14-11-4-3-8-5-10(2-1-9(8)6-11)13-17-16-12(7-15)18-13/h1-6H,7H2
InChI Key:
ZOCBTNLABWNHCK-UHFFFAOYSA-N
SMILES:
ClCc1nnc(o1)c1ccc2c(c1)ccc(c2)Br
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.951g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.574g/mol
Monoisotopic Mass:
321.951g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties