m-Cresol-d8

Base Information

• Chemical Name: m-Cresol-d8
• CAS No.: 302911-90-6
• Molecular Formula: C7D8O
• Molecular Weight: 116.19
• European Community (EC) Number: 687-241-0
• DSSTox Substance ID: DTXSID50583732
• Wikidata: Q82475336
• Mol file: 302911-90-6.mol

Synonyms:m-Cresol-d8;302911-90-6;1,2,3,5-tetradeuterio-4-deuteriooxy-6-(trideuteriomethyl)benzene;DTXSID50583732;3-(~2~H_3_)Methyl(O-~2~H_5_)phenol;m-Cresol-d8, 98 atom % D, 98% (CP);D99578

Chemical Property of m-Cresol-d8

Chemical Property:

• Melting Point: 8-10 °C(lit.)
• Refractive Index: n20/D 1.538(lit.)
• Boiling Point: 202.3 °C at 760 mmHg
• Flash Point: 86.1 °C
• PSA: 20.23000
• Density: 1.115 g/cm³
• LogP: 1.70060
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 116.107728842
• Heavy Atom Count: 8
• Complexity: 70.8

Purity/Quality:

99% ^*data from raw suppliers

META-CRESOL-D8 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 23/24/25-34
• Safety Statements: 23-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)O
• Isomeric SMILES: [2H]C1=C(C(=C(C(=C1[2H])O[2H])[2H])C([2H])([2H])[2H])[2H]