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2-Propenoic acid, 2-methyl-, 2-(1,1-dimethylethyl)-6-((3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl)methyl)-4-methylphenyl ester

HCID 109059
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
61167-60-0
Standard SMILES
C=C(C)C(=O)Oc1c(Cc2cc(C)cc(C(C)(C)C)c2O)cc(C)cc1C(C)(C)C
InChIKey
ZVMCTBRFAFJZHQ-UHFFFAOYSA-N
Molecular formula
C27H36O3
Average molar mass
408.6 g/mol
Monoisotopic mass
408.26644501

Names & identifiers

Preferred name
2-Propenoic acid, 2-methyl-, 2-(1,1-dimethylethyl)-6-((3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl)methyl)-4-methylphenyl ester
IUPAC
[2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl] 2-methylprop-2-enoate
English name
2-Methylacrylic acid 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl ester
Molecular formula
C27H36O3
Molecular weight
408.57

Names & synonyms

2-Propenoic acid, 2-methyl-, 2-(1,1-dimethylethyl)-6-((3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl)methyl)-4-methylphenyl ester2-Propenoic acid, 2-methyl-, 2-(1,1-dimethylethyl)-6-[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methylphenyl esterRefChem:47951861167-60-02-(2-Hydroxy-3-tert-butyl-5-methylbenzyl)-4-methyl-6-tert-butylphenyl methacrylateSCHEMBL499728DTXSID1069459SCHEMBL294078042-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl 2-methylprop-2-enoateDB-3141512,2'-methylenebis(6-tert-butyl-4-methylphenol) monomethacrylate2-tert-Butyl-6-(3-tert-butyl-2-hydroxy-5-methylbenzyl)-4-methylphenyl 2-methylacrylate #
Show more names
2-Methylacrylic acid 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl ester
2-Methylacrylic acid 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl ]-4-methylphenyl ester

Properties

Computed structural propertiesFilling in

XLogP
8.3
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
30
Formal charge
0
Complexity
609

Physicochemical properties

EPA Substance Registry System
2 · 2-(2-Hydroxy-3-tert-butyl-5-methylbenzyl)-4-methyl-6-tert-butylphenyl methacrylate (61167-60-0)
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.

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Propenoic acid, 2-methyl-, 2-(1,1-dimethylethyl)-6-[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methylphenyl ester: INACTIVE

Related reactions

1 records
New reaction record
HRID 638670 reaction equation
HRID 638670As productuspto-grants-1985_12

Compound notes

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Database identifiers

CAS
61167-60-0
PubChem CID
109059
DTXSID
DTXSID1069459
Nikkaji
J131.873J