Toluene, diethyl-
Basic information
- CAS
25550-13-4- Standard SMILES
CCc1cc(C)cc(CC)c1.CCc1ccc(C)c(CC)c1.CCc1ccc(C)cc1CC.CCc1cccc(C)c1CC.CCc1cccc(CC)c1C- InChIKey
LRJOXARIJKBUFE-UHFFFAOYSA-N- Molecular formula
- C55H80
- Average molar mass
- 741.2 g/mol
- Monoisotopic mass
- 740.62600255
Names & identifiers
- Preferred name
- Toluene, diethyl-
- IUPAC
- 1,2-diethyl-3-methylbenzene;1,2-diethyl-4-methylbenzene;1,3-diethyl-2-methylbenzene;1,3-diethyl-5-methylbenzene;2,4-diethyl-1-methylbenzene
- English name
- Diethylmethylbenzene
- Molecular formula
- C11H16
- Molecular weight
- 148.25
Names & synonyms
Toluene, diethyl-UNII-Y10TA1HI24Y10TA1HI24Diethylmethylbenzene
Database identifiers
- CAS
25550-13-4- PubChem CID
- 33043
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 10
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 509
Physicochemical properties
- FDA UNII
- 10 TA1HI24 · Y10TA1HI24
- EPA Substance Registry System
- Benzene, diethylmethyl- (25550-13-4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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