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121859-57-2 | 1H-Indole, 5,6-dichloro-
CAS No: 121859-57-2 Catalog No: AG001652 MDL No:MFCD01075036
Product Description
Catalog Number:
AG001652
Chemical Name:
1H-Indole, 5,6-dichloro-
CAS Number:
121859-57-2
Molecular Formula:
C8H5Cl2N
Molecular Weight:
186.0380
MDL Number:
MFCD01075036
IUPAC Name:
5,6-dichloro-1H-indole
InChI:
InChI=1S/C8H5Cl2N/c9-6-3-5-1-2-11-8(5)4-7(6)10/h1-4,11H
InChI Key:
ILINOHVVKWYAFM-UHFFFAOYSA-N
SMILES:
Clc1cc2[nH]ccc2cc1Cl
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.98g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.035g/mol
Monoisotopic Mass:
184.98g/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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