Home Halogens 4-bromo-5-methyl-3-phenyl-1,2-oxazole

4-bromo-5-methyl-3-phenyl-1,2-oxazole

CAS No.:
31295-65-5
Catalog Number:
AG01DD1C
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
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Product Description
Catalog Number:
AG01DD1C
Chemical Name:
4-bromo-5-methyl-3-phenyl-1,2-oxazole
CAS Number:
31295-65-5
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
MDL Number:
MFCD27939282
IUPAC Name:
4-bromo-5-methyl-3-phenyl-1,2-oxazole
InChI:
InChI=1S/C10H8BrNO/c1-7-9(11)10(12-13-7)8-5-3-2-4-6-8/h2-6H,1H3
InChI Key:
BOAIRCXZUYJGKO-UHFFFAOYSA-N
SMILES:
Cc1onc(c1Br)c1ccccc1
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.979g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.084g/mol
Monoisotopic Mass:
236.979g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties