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117009-31-1 | Naphtho[2,3-b]-1,4-dioxin, 2,3-dihydro-
CAS No: 117009-31-1 Catalog No: AG000DJX MDL No:
Product Description
Catalog Number:
AG000DJX
Chemical Name:
Naphtho[2,3-b]-1,4-dioxin, 2,3-dihydro-
CAS Number:
117009-31-1
Molecular Formula:
C12H10O2
Molecular Weight:
186.2066
IUPAC Name:
2,3-dihydrobenzo[g][1,4]benzodioxine
InChI:
InChI=1S/C12H10O2/c1-2-4-10-8-12-11(7-9(10)3-1)13-5-6-14-12/h1-4,7-8H,5-6H2
InChI Key:
TYTYXUXJUAZIRI-UHFFFAOYSA-N
SMILES:
C1COc2c(O1)cc1c(c2)cccc1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.068g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.21g/mol
Monoisotopic Mass:
186.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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