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179169-95-0 | 4-Isoxazolepentanal,3-ethoxy-5-methyl-(9CI)
CAS No: 179169-95-0 Catalog No: AG00B41J MDL No:
Product Description
Catalog Number:
AG00B41J
Chemical Name:
4-Isoxazolepentanal,3-ethoxy-5-methyl-(9CI)
CAS Number:
179169-95-0
IUPAC Name:
5-(3-ethoxy-5-methyl-1,2-oxazol-4-yl)pentanal
InChI:
InChI=1S/C11H17NO3/c1-3-14-11-10(9(2)15-12-11)7-5-4-6-8-13/h8H,3-7H2,1-2H3
InChI Key:
JCZBUKVYYNOSPG-UHFFFAOYSA-N
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.261g/mol
Monoisotopic Mass:
211.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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