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154229-60-4 | 4-Isoxazolepropanal,3-methoxy-5-methyl-(9CI)
CAS No: 154229-60-4 Catalog No: AG00B40F MDL No:
Product Description
Catalog Number:
AG00B40F
Chemical Name:
4-Isoxazolepropanal,3-methoxy-5-methyl-(9CI)
CAS Number:
154229-60-4
IUPAC Name:
3-(3-methoxy-5-methyl-1,2-oxazol-4-yl)propanal
InChI:
InChI=1S/C8H11NO3/c1-6-7(4-3-5-10)8(11-2)9-12-6/h5H,3-4H2,1-2H3
InChI Key:
JAEJHAKISZEODP-UHFFFAOYSA-N
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.18g/mol
Monoisotopic Mass:
169.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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