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144104-53-0 | 1H-Indole, 5-(3-furanyl)-
CAS No: 144104-53-0 Catalog No: AG001IXK MDL No:MFCD04114726
Product Description
Catalog Number:
AG001IXK
Chemical Name:
1H-Indole, 5-(3-furanyl)-
CAS Number:
144104-53-0
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
MDL Number:
MFCD04114726
IUPAC Name:
5-(furan-3-yl)-1H-indole
InChI:
InChI=1S/C12H9NO/c1-2-12-10(3-5-13-12)7-9(1)11-4-6-14-8-11/h1-8,13H
InChI Key:
DCROHJHXMCNULF-UHFFFAOYSA-N
SMILES:
c1occ(c1)c1ccc2c(c1)cc[nH]2
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.068g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.21g/mol
Monoisotopic Mass:
183.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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