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65685-55-4 | 1,2-Benzisoxazol-6-ol
CAS No: 65685-55-4 Catalog No: AG00FBRB MDL No:MFCD09999144
Product Description
Catalog Number:
AG00FBRB
Chemical Name:
1,2-Benzisoxazol-6-ol
CAS Number:
65685-55-4
Molecular Formula:
C7H5NO2
Molecular Weight:
135.1201
MDL Number:
MFCD09999144
IUPAC Name:
1,2-benzoxazol-6-ol
InChI:
InChI=1S/C7H5NO2/c9-6-2-1-5-4-8-10-7(5)3-6/h1-4,9H
InChI Key:
OBSZDVDXNVEDKQ-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)onc2
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.032g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.122g/mol
Monoisotopic Mass:
135.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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