1-(2-Chlorophenyl)-2,3,4,5,6-pentadeuteriobenzene

Base Information

• Chemical Name: 1-(2-Chlorophenyl)-2,3,4,5,6-pentadeuteriobenzene
• CAS No.: 51624-35-2
• Molecular Formula: C12H4ClD5
• Molecular Weight: 193.68
• European Community (EC) Number: 685-190-9
• DSSTox Substance ID: DTXSID40584415
• Nikkaji Number: J149.350G
• Wikidata: Q72449717
• Mol file: 51624-35-2.mol

Synonyms:51624-35-2;2'-Chlorodiphenyl-2,3,4,5,6-d5;1-(2-chlorophenyl)-2,3,4,5,6-pentadeuteriobenzene;CID 16217485;PCB No. 1 D5 100 microg/mL in Isooctane;2-Chlorobiphenyl-2 inverted exclamation marka,3 inverted exclamation marka,4 inverted exclamation marka,5 inverted exclamation marka,6 inverted exclamation marka-d5;DTXSID40584415;HY-W015267S;2-Chlorobiphenyl-2',3',4',5',6'-d5;CS-0566696;D98713;2'-Chlorodiphenyl-2,3,4,5,6-d5, 98 atom % D;2-chloro(2',3',4',5',6'-?H?)-1,1'-biphenyl;2-Chloro(2',3',4',5',6'-~2~H_5_)-1,1'-biphenyl;1,1'-Biphenyl-2,3,4,5,6-d5, 2'-chloro- (9CI);2-Chlorobiphenyl D5;2'-Chloro-2,3,4,5,6-pentadeuterio-1,1'-biphenyl

Chemical Property of 1-(2-Chlorophenyl)-2,3,4,5,6-pentadeuteriobenzene

Chemical Property:

• Melting Point: 32 °C(lit.)
• Boiling Point: 274 °C at 760 mmHg
• Flash Point: 115.918 °C
• PSA: 0.00000
• Density: 1.162g/cm³
• LogP: 4.00700
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 193.0706617
• Heavy Atom Count: 13
• Complexity: 149

Purity/Quality:

99% ^*data from raw suppliers

2-Chlorodiphenyl-2?,3?,4?,5?,6?-d5 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: N
• Statements: 33-50/53
• Safety Statements: 35-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC=CC=C2Cl
• Isomeric SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])C2=CC=CC=C2Cl)[2H])[2H]
• Uses: 2-Chlorobiphenyl-2'',3'',4'',5'',6''-d5 (CAS# 51624-35-2) is a useful isotopically labeled research compound.