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127020-26-2 | Isoxazole, 3-ethoxy-4,5-dimethyl-
CAS No: 127020-26-2 Catalog No: AG000WK6 MDL No:
Product Description
Catalog Number:
AG000WK6
Chemical Name:
Isoxazole, 3-ethoxy-4,5-dimethyl-
CAS Number:
127020-26-2
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
IUPAC Name:
3-ethoxy-4,5-dimethyl-1,2-oxazole
InChI:
InChI=1S/C7H11NO2/c1-4-9-7-5(2)6(3)10-8-7/h4H2,1-3H3
InChI Key:
XVEJAONDLBAHCK-UHFFFAOYSA-N
SMILES:
CCOc1noc(c1C)C
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.17g/mol
Monoisotopic Mass:
141.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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