Chlorobenzene
Chlorobenzene synonyms
Phenyl chloride; benzene, chloro-; Monochlorbenzol; Benzene chloride; PhCl; Chlorobenzene; Benzene, chloro-; Monochlorobenzene
Graphical representations:
View large 3D structure
Molecular Formula: C6H5Cl
Natural Isotopic Abundance Mass: 112.5569
Mono-Isotopic Molecular Masses:
- C12N14: 112.0079778705
- C13N14: 118.0281068973
- C12N15: 112.0079778705
- C13N15: 118.0281068973
InChI string: InChI=1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H
PubChem Compound (CID): 7964CAS Registry number: 108-90-7
ChEBI: CHEBI:28097
KEGG Compound ID: C06990
NMRShiftDB: 20036224
NIST: 3700541277
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)