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69429-70-5 | 9-hydroxy-7,7-dimethyl-9$l^{3}-ioda-8-oxabicyclo[4.3.0]nona-1,3,5-trie ne
CAS No: 69429-70-5 Catalog No: AG00FC6C MDL No:
Product Description
Catalog Number:
AG00FC6C
Chemical Name:
9-hydroxy-7,7-dimethyl-9$l^{3}-ioda-8-oxabicyclo[4.3.0]nona-1,3,5-trie ne
CAS Number:
69429-70-5
IUPAC Name:
1-hydroxy-3,3-dimethyl-1λ3,2-benziodoxole
InChI:
InChI=1S/C9H11IO2/c1-9(2)7-5-3-4-6-8(7)10(11)12-9/h3-6,11H,1-2H3
InChI Key:
LYUULLIYJCLGFU-UHFFFAOYSA-N
NSC Number:
312854
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.98g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.089g/mol
Monoisotopic Mass:
277.98g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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