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5599-71-3 | 3,6-Dichloro-9H-carbazole
CAS No: 5599-71-3 Catalog No: AG003IQD MDL No:MFCD00218271
Product Description
Catalog Number:
AG003IQD
Chemical Name:
3,6-Dichloro-9H-carbazole
CAS Number:
5599-71-3
Molecular Formula:
C12H7Cl2N
Molecular Weight:
236.0967
MDL Number:
MFCD00218271
IUPAC Name:
3,6-dichloro-9H-carbazole
InChI:
InChI=1S/C12H7Cl2N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6,15H
InChI Key:
BIMDTNQPZWJKPL-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c1cc(Cl)ccc1[nH]2
NSC Number:
39031
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.996g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.095g/mol
Monoisotopic Mass:
234.996g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
Literature
| Title | Journal |
|---|---|
| Fluorogenic sensing of CH3CO2- and H2PO4- by ditopic receptor through conformational change. | Organic & biomolecular chemistry 20120314 |
| Degradative fate of 3-chlorocarbazole and 3,6-dichlorocarbazole in soil. | Environmental science and pollution research international 20110501 |
| Anthropogenic organic contaminants in sediments of the Lippe river, Germany. | Water research 20040901 |
| Density functional theory studies on the structures and vibrational spectra of 3,6-dichlorocarbazole and 3,6-dibromocarbazole. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20020801 |
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