1,1′-Biphenyl-1,1′,2,2′,3,3′,4,4′,5,5′,6,6′-13C12, 3,3′,4,4′-tetrachloro-
CAS Registry Number®
105600-23-5
CAS Name
1,1′-Biphenyl-1,1′,2,2′,3,3′,4,4′,5,5′,6,6′-13C12, 3,3′,4,4′-tetrachloro-Molecular Formula
C12H6Cl4Cite this Page
1,1′-Biphenyl-1,1′,2,2′,3,3′,4,4′,5,5′,6,6′-13C12, 3,3′,4,4′-tetrachloro-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=105600-23-5 (retrieved ) (CAS RN: 105600-23-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
176-177 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C12H6Cl4/c13-9-3-1-7(5-11(9)15)8-2-4-10(14)12(16)6-8/h1-6H/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1
InChIKey
InChIKey=UQMGJOKDKOLIDP-WCGVKTIYSA-N
SMILES
Cl[13C]=1[13CH]=[13C]([13CH]=[13CH][13C]1Cl)[13C]2=[13CH][13C](Cl)=[13C](Cl)[13CH]=[13CH]2
Canonical SMILES
ClC=1C=CC(=CC1Cl)C2=CC=C(Cl)C(Cl)=C2
Other Names for this Substance
- 1,1′-Biphenyl-1,1′,2,2′,3,3′,4,4′,5,5′,6,6′-13C12, 3,3′,4,4′-tetrachloro-
- PCB 77-13C12
- 13C12-3,3′,4,4′-Tetrachlorobiphenyl
- 13C12-PCB 77
- 13C12-3,3′,4,4′-TeCB
