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257928-27-1 | 1,2-Benzisoxazol-4(5H)-one,6,7-dihydro-3-methoxy-(9CI)
CAS No: 257928-27-1 Catalog No: AG00BLI6 MDL No:
Product Description
Catalog Number:
AG00BLI6
Chemical Name:
1,2-Benzisoxazol-4(5H)-one,6,7-dihydro-3-methoxy-(9CI)
CAS Number:
257928-27-1
IUPAC Name:
3-methoxy-6,7-dihydro-5H-1,2-benzoxazol-4-one
InChI:
InChI=1S/C8H9NO3/c1-11-8-7-5(10)3-2-4-6(7)12-9-8/h2-4H2,1H3
InChI Key:
XUVOFXZHAXRKCO-UHFFFAOYSA-N
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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