Home Halogens Isoxazole, 5-(bromomethyl)-3-ethyl-

Isoxazole, 5-(bromomethyl)-3-ethyl-

CAS No.:
36958-62-0
Catalog Number:
AG0077B8
Molecular Formula:
C6H8BrNO
Molecular Weight:
190.0378
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Product Description
Catalog Number:
AG0077B8
Chemical Name:
Isoxazole, 5-(bromomethyl)-3-ethyl-
CAS Number:
36958-62-0
Molecular Formula:
C6H8BrNO
Molecular Weight:
190.0378
MDL Number:
MFCD19665211
IUPAC Name:
5-(bromomethyl)-3-ethyl-1,2-oxazole
InChI:
InChI=1S/C6H8BrNO/c1-2-5-3-6(4-7)9-8-5/h3H,2,4H2,1H3
InChI Key:
YCZVNYPFSNGXGJ-UHFFFAOYSA-N
SMILES:
CCc1noc(c1)CBr
Properties
Complexity:
89.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.979g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.04g/mol
Monoisotopic Mass:
188.979g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties