Pentachlorophenol-13C6

Base Information

• Chemical Name: Pentachlorophenol-13C6
• CAS No.: 85380-74-1
• Molecular Formula: C6H Cl5 O
• Molecular Weight: 272.29200
• Hs Code.: 2908110000
• European Community (EC) Number: 690-346-4
• DSSTox Substance ID: DTXSID30483529
• Wikidata: Q82320910
• Mol file: 85380-74-1.mol

Synonyms:Pentachlorophenol-13C6;85380-74-1;Pentachlorophenol 13C6;2,3,4,5,6-pentachloro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-ol;Pentachlorophenol-13C6 1000 microg/mL in Methanol;Pentachlorophenol 13C6 100 microg/mL in Cyclohexane;Phenol-1,2,3,4,5,6-13C6, 2,3,4,5,6-pentachloro-;Phenol-13C6, pentachloro- (9CI);2,3,4,5,6-Pentachlorophenol-1,2,3,4,5,6-13C6;SCHEMBL1330735;DTXSID30483529;F91229;Pentachlorophenol-13C6, 99 atom % 13C, 98% (CP)

Chemical Property of Pentachlorophenol-13C6

Chemical Property:

• PSA: 20.23000
• LogP: 4.65920
• Storage Temp.: 0-6°C
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 271.864182
• Heavy Atom Count: 12
• Complexity: 150

Purity/Quality:

99% ^*data from raw suppliers

Pentachlorophenol-13C6 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T+,N
• Hazard Codes: T+,N
• Statements: 24/25-26-36/37/38-40-50/53
• Safety Statements: 22-36/37-45-52-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)O
• Isomeric SMILES: [13C]1(=[13C]([13C](=[13C]([13C](=[13C]1Cl)Cl)Cl)Cl)Cl)O