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343788-75-0 | 1H-[1,4]Dioxino[2,3-f]benzimidazole,6,7-dihydro-(9CI)
CAS No: 343788-75-0 Catalog No: AG00CWR5 MDL No:MFCD10007523
Product Description
Catalog Number:
AG00CWR5
Chemical Name:
1H-[1,4]Dioxino[2,3-f]benzimidazole,6,7-dihydro-(9CI)
CAS Number:
343788-75-0
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD10007523
IUPAC Name:
6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazole
InChI:
InChI=1S/C9H8N2O2/c1-2-13-9-4-7-6(10-5-11-7)3-8(9)12-1/h3-5H,1-2H2,(H,10,11)
InChI Key:
WERQRLHRZGPICN-UHFFFAOYSA-N
SMILES:
C1COc2c(O1)cc1c(c2)nc[nH]1
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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