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332083-11-1 | 3H-1,2,3-Benzodioxazole (9CI)
CAS No: 332083-11-1 Catalog No: AG00CWGQ MDL No:
Product Description
Catalog Number:
AG00CWGQ
Chemical Name:
3H-1,2,3-Benzodioxazole (9CI)
CAS Number:
332083-11-1
IUPAC Name:
3H-1,2,3-benzodioxazole
InChI:
InChI=1S/C6H5NO2/c1-2-4-6-5(3-1)7-9-8-6/h1-4,7H
InChI Key:
PEPBFCOIJRULGJ-UHFFFAOYSA-N
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.032g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
123.111g/mol
Monoisotopic Mass:
123.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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