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101495-18-5 | 1H-Indole, 4,6-dichloro-
CAS No: 101495-18-5 Catalog No: AG0004M5 MDL No:MFCD03094990
Product Description
Catalog Number:
AG0004M5
Chemical Name:
1H-Indole, 4,6-dichloro-
CAS Number:
101495-18-5
Molecular Formula:
C8H5Cl2N
Molecular Weight:
186.0380
MDL Number:
MFCD03094990
IUPAC Name:
4,6-dichloro-1H-indole
InChI:
InChI=1S/C8H5Cl2N/c9-5-3-7(10)6-1-2-11-8(6)4-5/h1-4,11H
InChI Key:
NIXGYRHZQFZCCV-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c2c(c1)[nH]cc2
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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