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Home > Bromides > 1263378-26-2
1263378-26-2 | Isoxazole, 5-bromo-3-methyl-
CAS No: 1263378-26-2 Catalog No: AG000SOS MDL No:MFCD11216979
Product Description
Catalog Number:
AG000SOS
Chemical Name:
Isoxazole, 5-bromo-3-methyl-
CAS Number:
1263378-26-2
Molecular Formula:
C4H4BrNO
Molecular Weight:
161.9847
MDL Number:
MFCD11216979
IUPAC Name:
5-bromo-3-methyl-1,2-oxazole
InChI:
InChI=1S/C4H4BrNO/c1-3-2-4(5)7-6-3/h2H,1H3
InChI Key:
FLVASSBEDDEYIT-UHFFFAOYSA-N
SMILES:
Cc1noc(c1)Br
Properties
Complexity:
68.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.948g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.986g/mol
Monoisotopic Mass:
160.948g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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