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Home > Indoles and Oxindole > 91029-07-1
91029-07-1 | 2,5'-Bi-1H-indole
CAS No: 91029-07-1 Catalog No: AG006RIR MDL No:
Product Description
Catalog Number:
AG006RIR
Chemical Name:
2,5'-Bi-1H-indole
CAS Number:
91029-07-1
Molecular Formula:
C16H12N2
Molecular Weight:
232.2799
IUPAC Name:
2-(1H-indol-5-yl)-1H-indole
InChI:
InChI=1S/C16H12N2/c1-2-4-15-11(3-1)10-16(18-15)12-5-6-14-13(9-12)7-8-17-14/h1-10,17-18H
InChI Key:
CXDKNFOMQPVHOD-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)[nH]c(c2)c1ccc2c(c1)cc[nH]2
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.286g/mol
Monoisotopic Mass:
232.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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