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89502-01-2 | Thiazole, 4-bromo-5-ethoxy-2-methyl-
CAS No: 89502-01-2 Catalog No: AG0041FJ MDL No:
Product Description
Catalog Number:
AG0041FJ
Chemical Name:
Thiazole, 4-bromo-5-ethoxy-2-methyl-
CAS Number:
89502-01-2
Molecular Formula:
C6H8BrNOS
Molecular Weight:
222.1028
IUPAC Name:
4-bromo-5-ethoxy-2-methyl-1,3-thiazole
InChI:
InChI=1S/C6H8BrNOS/c1-3-9-6-5(7)8-4(2)10-6/h3H2,1-2H3
InChI Key:
NWQPXDFTPXCHHA-UHFFFAOYSA-N
SMILES:
CCOc1sc(nc1Br)C
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.951g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.1g/mol
Monoisotopic Mass:
220.951g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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