1,2,3,5-Tetramethylbenzene

• CAS: 527-53-7
• Catalog Number: ACM527537
• Category: Other Products
• Molecular Weight: 134.22
• Molecular Formula: C10H14
• Synonyms: Benzene, 1,2,3,5-tetramethyl-
• IUPAC Name: 1,2,3,5-tetramethylbenzene
• Canonical SMILES: CC1=CC(=C(C(=C1)C)C)C
• InChI Key: BFIMMTCNYPIMRN-UHFFFAOYSA-N
• Boiling Point: 198ºC
• Melting Point: -24ºC
• Flash Point: 63ºC
• Density: 0.89 g/cm³
• Appearance: clear colourless to pale yellow liquid
• Complexity: 95
• Defined Atom Stereocenter Count: 0
• EC Number: 208-417-1
• Exact Mass: 134.1095
• Formal Charge: 0
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 0
• Hydrogen Bond Donor Count: 0
• Isotope Atom Count: 0
• Monoisotopic Mass: 134.1095
• Rotatable Bond Count: 0
• Safety Description: S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . S24/25:Avoid contact with skin and eyes . S23:Do not breathe gas/fumes/vapor
• Topological Polar Surface Area: 0 Ų
• UN Number: 1993
• XLogP3-AA: 4