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1246088-40-3 | 7-Iodo-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-8-ol
CAS No: 1246088-40-3 Catalog No: AG00HHPU MDL No:MFCD17171333
Product Description
Catalog Number:
AG00HHPU
Chemical Name:
7-Iodo-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-8-ol
CAS Number:
1246088-40-3
Molecular Formula:
C7H6INO3
Molecular Weight:
279.0319
MDL Number:
MFCD17171333
IUPAC Name:
7-iodo-3,5-dihydro-2H-[1,4]dioxino[2,3-b]pyridin-8-one
InChI:
InChI=1S/C7H6INO3/c8-4-3-9-7-6(5(4)10)11-1-2-12-7/h3H,1-2H2,(H,9,10)
InChI Key:
XDMBVVQYAZAKHH-UHFFFAOYSA-N
SMILES:
Ic1cnc2c(c1O)OCCO2
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.939g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.033g/mol
Monoisotopic Mass:
278.939g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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