Home Halogens 3-(bromomethyl)-4-methyl-1,2-oxazole

3-(bromomethyl)-4-methyl-1,2-oxazole

CAS No.:
952195-21-0
Catalog Number:
AG01DTE8
Molecular Formula:
C5H6BrNO
Molecular Weight:
176.0112
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Product Description
Catalog Number:
AG01DTE8
Chemical Name:
3-(bromomethyl)-4-methyl-1,2-oxazole
CAS Number:
952195-21-0
Molecular Formula:
C5H6BrNO
Molecular Weight:
176.0112
MDL Number:
MFCD30742131
IUPAC Name:
3-(bromomethyl)-4-methyl-1,2-oxazole
InChI:
InChI=1S/C5H6BrNO/c1-4-3-8-7-5(4)2-6/h3H,2H2,1H3
InChI Key:
WOTBMPWBOIUIKC-UHFFFAOYSA-N
SMILES:
Cc1conc1CBr
Properties
Complexity:
78.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.963g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.013g/mol
Monoisotopic Mass:
174.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties