4-Tert-butylphenol;formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;4-nonylphenol;oxirane
Basic information
- CAS
68155-79-3- Standard SMILES
C1CO1.C=O.CC(C)(C)c1ccc(O)cc1.CC1CO1.CCC(C)(C)c1ccc(O)cc1.CCCCCCCCCc1ccc(O)cc1- InChIKey
CXMGZKGILSETMX-UHFFFAOYSA-N- Molecular formula
- C42H66O6
- Average molar mass
- 667 g/mol
Names & identifiers
- Preferred name
- 4-Tert-butylphenol;formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;4-nonylphenol;oxirane
- IUPAC
- 4-tert-butylphenol;formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;4-nonylphenol;oxirane
- English name
- Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, 4-(1,1-dimethylpropyl)phenol, methyloxirane, 4-nonylphenol and oxirane
- Molecular formula
- C42H66O6
- Molecular weight
- 666.96984
Names & synonyms
Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, 4-(1,1-dimethylpropyl)phenol, methyloxirane, 4-nonylphenol and oxirane
Database identifiers
- CAS
68155-79-3
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 434
Physicochemical properties
- EPA Substance Registry System
- 4 · Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, 4-(1,1-dimethylpropyl)phenol, methyloxirane, 4-nonylphenol and oxirane (68155-79-3)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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