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1000341-82-1 | 1H-Indole, 4-chloro-7-iodo-
CAS No: 1000341-82-1 Catalog No: AG0000IA MDL No:
Product Description
Catalog Number:
AG0000IA
Chemical Name:
1H-Indole, 4-chloro-7-iodo-
CAS Number:
1000341-82-1
Molecular Formula:
C8H5ClIN
Molecular Weight:
277.4895
IUPAC Name:
4-chloro-7-iodo-1H-indole
InChI:
InChI=1S/C8H5ClIN/c9-6-1-2-7(10)8-5(6)3-4-11-8/h1-4,11H
InChI Key:
KUEVAPHSWQGJLC-UHFFFAOYSA-N
SMILES:
Clc1ccc(c2c1cc[nH]2)I
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.916g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.489g/mol
Monoisotopic Mass:
276.916g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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