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Home > Indoles and Oxindole > 16066-91-4
16066-91-4 | 1H-Indole, 5-iodo-
CAS No: 16066-91-4 Catalog No: AG001S3L MDL No:MFCD00220065
Product Description
Catalog Number:
AG001S3L
Chemical Name:
1H-Indole, 5-iodo-
CAS Number:
16066-91-4
Molecular Formula:
C8H6IN
Molecular Weight:
243.0444
MDL Number:
MFCD00220065
IUPAC Name:
5-iodo-1H-indole
InChI:
InChI=1S/C8H6IN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H
InChI Key:
TVQLYTUWUQMGMP-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)cc[nH]2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.954g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.047g/mol
Monoisotopic Mass:
242.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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