2,3,4,5,6-Pentafluorotoluene

• CAS: 771-56-2
• Catalog Number: ACM771562
• Category: Aryl
• Molecular Weight: 182.09
• Molecular Formula: C₇H₃F₅
• Synonyms: Pentafluorotoluene, Benzene, pentafluoromethyl-, Methylpentafluorobenzene, Methyl pentafluorobenzene, Pentafluoromethylbenzene, 2,3,4,5,6-Pentafluorotoluene, 103977_ALDRICH, Toluene, 2,3,4,5,6-pentafluoro-, NSC88285, CID69869, EINECS 212-233-7, NSC 88285, 2,3,4,5,6-PENTAFLUORO-TOLUENE, P116, TL8005298, Toluene, 2,3,4,5,6-pentafluoro- (8CI), Benzene, 1,2,3,4,5-pentafluoro-6-methyl-, 771-56-2
• IUPAC Name: 1,2,3,4,5-pentafluoro-6-methylbenzene
• Canonical SMILES: CC1=C(C(=C(C(=C1F)F)F)F)F
• InChI Key: SXPRVMIZFRCAGC-UHFFFAOYSA-N
• Boiling Point: 117ºC
• Melting Point: -30ºC(lit.)
• Flash Point: 34.4ºC
• Density: 1.44
• Appearance: Colorless Liquid
• EC Number: 212-233-7
• Exact Mass: 182.01500
• Hazard Statements: H315-H319-H335
• H-Bond Acceptor: 5
• H-Bond Donor: 0
• Packing Group: III
• RIDADR: NONH for all modes of transport
• Safety Description: S23-S26-S36
• Symbol: GHS07
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 2,3,4,5,6-Pentafluorotoluene?

The molecular formula of 2,3,4,5,6-Pentafluorotoluene is C7H3F5.

What is the molecular weight of 2,3,4,5,6-Pentafluorotoluene?

The molecular weight of 2,3,4,5,6-Pentafluorotoluene is 182.09 g/mol.

What is the IUPAC name of 2,3,4,5,6-Pentafluorotoluene?

The IUPAC name of 2,3,4,5,6-Pentafluorotoluene is 1,2,3,4,5-pentafluoro-6-methylbenzene.

What is the InChI of 2,3,4,5,6-Pentafluorotoluene?

The InChI of 2,3,4,5,6-Pentafluorotoluene is InChI=1S/C7H3F5/c1-2-3(8)5(10)7(12)6(11)4(2)9/h1H3.

What is the InChIKey of 2,3,4,5,6-Pentafluorotoluene?

The InChIKey of 2,3,4,5,6-Pentafluorotoluene is SXPRVMIZFRCAGC-UHFFFAOYSA-N.

What is the canonical SMILES of 2,3,4,5,6-Pentafluorotoluene?

The canonical SMILES of 2,3,4,5,6-Pentafluorotoluene is CC1=C(C(=C(C(=C1F)F)F)F)F.

What is the CAS number of 2,3,4,5,6-Pentafluorotoluene?

The CAS number of 2,3,4,5,6-Pentafluorotoluene is 771-56-2.

What is the EC number of 2,3,4,5,6-Pentafluorotoluene?

The EC number of 2,3,4,5,6-Pentafluorotoluene is 212-233-7.

What is the UNII number of 2,3,4,5,6-Pentafluorotoluene?

The UNII number of 2,3,4,5,6-Pentafluorotoluene is YZ42CXN177.

Is 2,3,4,5,6-Pentafluorotoluene a canonicalized compound?

Yes, 2,3,4,5,6-Pentafluorotoluene is a canonicalized compound.