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235-93-8 | 2H-Dibenz[e,g]isoindole
CAS No: 235-93-8 Catalog No: AG002NET MDL No:MFCD23135516
Product Description
Catalog Number:
AG002NET
Chemical Name:
2H-Dibenz[e,g]isoindole
CAS Number:
235-93-8
Molecular Formula:
C16H11N
Molecular Weight:
217.2652
MDL Number:
MFCD23135516
IUPAC Name:
2H-phenanthro[9,10-c]pyrrole
InChI:
InChI=1S/C16H11N/c1-3-7-13-11(5-1)12-6-2-4-8-14(12)16-10-17-9-15(13)16/h1-10,17H
InChI Key:
SHNNRQRIBNWMNI-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1ccccc1c1c2c[nH]c1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.089g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.271g/mol
Monoisotopic Mass:
217.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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