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Home > Bromides > 1254962-88-3
1254962-88-3 | ethyl 3-bromo-5-methyl-1,2-oxazole-4-carboxylate
CAS No: 1254962-88-3 Catalog No: AG01EL5U MDL No:MFCD25949305
Product Description
Catalog Number:
AG01EL5U
Chemical Name:
ethyl 3-bromo-5-methyl-1,2-oxazole-4-carboxylate
CAS Number:
1254962-88-3
Molecular Formula:
C7H8BrNO3
Molecular Weight:
234.0473
MDL Number:
MFCD25949305
IUPAC Name:
ethyl 3-bromo-5-methyl-1,2-oxazole-4-carboxylate
InChI:
InChI=1S/C7H8BrNO3/c1-3-11-7(10)5-4(2)12-9-6(5)8/h3H2,1-2H3
InChI Key:
LURPTDYVMCBBPQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(C)onc1Br
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.969g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.049g/mol
Monoisotopic Mass:
232.969g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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