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Home > Indoles and Oxindole > 1216180-86-7
1216180-86-7 | 2H,3H,6H,7H,8H-[1,4]dioxino[2,3-f]indol-7-one
CAS No: 1216180-86-7 Catalog No: AG01AD12 MDL No:MFCD12403673
Product Description
Catalog Number:
AG01AD12
Chemical Name:
2H,3H,6H,7H,8H-[1,4]dioxino[2,3-f]indol-7-one
CAS Number:
1216180-86-7
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD12403673
IUPAC Name:
2,3,6,8-tetrahydro-[1,4]dioxino[2,3-f]indol-7-one
InChI:
InChI=1S/C10H9NO3/c12-10-4-6-3-8-9(5-7(6)11-10)14-2-1-13-8/h3,5H,1-2,4H2,(H,11,12)
InChI Key:
NIXBYYISFAXGLX-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(N1)cc1c(c2)OCCO1
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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