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1428139-91-6 | 6-(5-Methyl-2-furyl)-6,7-dihydro-1,2-benzisoxazol-4(5H)-one
CAS No: 1428139-91-6 Catalog No: AG00HWON MDL No:
Product Description
Catalog Number:
AG00HWON
Chemical Name:
6-(5-Methyl-2-furyl)-6,7-dihydro-1,2-benzisoxazol-4(5H)-one
CAS Number:
1428139-91-6
IUPAC Name:
6-(5-methylfuran-2-yl)-6,7-dihydro-5H-1,2-benzoxazol-4-one
InChI:
InChI=1S/C12H11NO3/c1-7-2-3-11(15-7)8-4-10(14)9-6-13-16-12(9)5-8/h2-3,6,8H,4-5H2,1H3
InChI Key:
ROHBEFQPMZDQFM-UHFFFAOYSA-N
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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