Product Name
4-Chloro-o-phenylenediamine
Synonyms
4-Chloro-1,2-diaminobenzene
Description
4-chloro-o-phenylenediamine appears as brown crystalline solid or powder. (NTP, 1992)
IUPAC Name
4-chlorobenzene-1,2-diamine
Molecular Formula
ClC6H3(NH2)2
Canonical SMILES
Nc1ccc(Cl)cc1N
InChI
1S/C6H7ClN2/c7-4-1-2-5(8)6(9)3-4/h1-3H,8-9H2
InChI Key
BXIXXXYDDJVHDL-UHFFFAOYSA-N
Melting Point
70-73 °C (lit.)
Solubility
less than 1 mg/mL at 66° F (NTP, 1992);Soluble in benzene, very soluble in ethanol, ether.;Slightly soluble in water
Application
Undergoes cyclizations and cyclocondensations to form benzimidazoles.
Covalently-Bonded Unit Count
1
Exact Mass
142.029776g/mol
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Log P
1.28 (LogP);log Kow = 1.28
MeSH Entry Terms
4-chloro-1,2-diaminobenzene;4-chloro-1,2-diaminobenzene sulfate (1:1);4-chloro-o-phenylenediamine
Monoisotopic Mass
142.029776g/mol
Packaging
Packaging
5, 25 g in glass bottle