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95104-40-8 | Ethyl 5-hydroxymethyl-3-methylisoxazole-4-carboxylate
CAS No: 95104-40-8 Catalog No: AG01FGXF MDL No:
Product Description
Catalog Number:
AG01FGXF
Chemical Name:
Ethyl 5-hydroxymethyl-3-methylisoxazole-4-carboxylate
CAS Number:
95104-40-8
IUPAC Name:
ethyl 5-(hydroxymethyl)-3-methyl-1,2-oxazole-4-carboxylate
InChI:
InChI=1S/C8H11NO4/c1-3-12-8(11)7-5(2)9-13-6(7)4-10/h10H,3-4H2,1-2H3
InChI Key:
IEEJBOFPPOHDNU-UHFFFAOYSA-N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.179g/mol
Monoisotopic Mass:
185.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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