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Home > Bromides > 1239489-82-7
1239489-82-7 | Benzoxazole, 7-bromo-2-methyl-
CAS No: 1239489-82-7 Catalog No: AG000L8Z MDL No:MFCD12965124
Product Description
Catalog Number:
AG000L8Z
Chemical Name:
Benzoxazole, 7-bromo-2-methyl-
CAS Number:
1239489-82-7
Molecular Formula:
C8H6BrNO
Molecular Weight:
212.0433
MDL Number:
MFCD12965124
IUPAC Name:
7-bromo-2-methyl-1,3-benzoxazole
InChI:
InChI=1S/C8H6BrNO/c1-5-10-7-4-2-3-6(9)8(7)11-5/h2-4H,1H3
InChI Key:
BKDLGCJXIKUIRB-UHFFFAOYSA-N
SMILES:
Cc1nc2c(o1)c(Br)ccc2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.963g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.046g/mol
Monoisotopic Mass:
210.963g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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