2-ethylhexyl [[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]acetate (CAS 80387-97-9) — formula C25H42O3S, molecular weight 422.7; category organic chemicals.
| CAS Number | 80387-97-9 |
|---|---|
| Molecular Formula | C25H42O3S |
| Molecular Weight | 422.7 |
| LogP | 8.4 |
| Applications | General Manufacturing Information: Acetic acid, 2-[[[3, 5-bis(1, 1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]-, 2-ethylhexyl ester: INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Acetic acid, 2-[[[3, 5-bis(1, 1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]-, 2-ethylhexyl ester: INACTIVE.
2-ethylhexyl [[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]acetate is a carbon-based organic compound with CAS registry number 80387-97-9 and molecular formula C25H42O3S (molecular weight 422.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 80387-97-9
Its molecular formula C25H42O3S comprises 25 C, 42 H, 3 O, 1 S atoms.
Also known as: 2-ethylhexyl [[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]acetate · (((3,5-双(1,1-二甲基乙基)-4-羟基苯基)甲基)硫代)乙酸2-乙基己基酯
Category: organic chemicals
The CAS registry number of 2-ethylhexyl [[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]acetate is 80387-97-9.
Molecular formula C25H42O3S, molecular weight 422.7.
It is also registered under: 2-ethylhexyl [[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]acetate, (((3,5-双(1,1-二甲基乙基)-4-羟基苯基)甲基)硫代)乙酸2-乙基己基酯.
Recorded applications: General Manufacturing Information: Acetic acid, 2-[[[3, 5-bis(1, 1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]-, 2-ethylhexyl ester: INACTIVE.
Category: Organic Chemicals.
Independent reference data for 2-ethylhexyl [[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]acetate (CAS 80387-97-9), compiled from public chemistry databases.
| CAS 号 | 80387-97-9 |
|---|---|
| PubChem CID | 93464 |
| 分子式 | C25H42O3S |
| IUPAC 名称 | 2-ethylhexyl 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanyl]acetate |
| UNII（FDA） | A6LGK467BT |
| Molecular Weight | 422.7 |
|---|---|
| XLogP3 | 8.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 13 |
| Exact Mass | 422.28546637 |
| Monoisotopic Mass | 422.28546637 |
| Topological Polar Surface Area | 71.8 |
| Heavy Atom Count | 29 |
DTXSID90868570; Acetic acid, (((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methyl)thio)-, 2-ethylhexyl ester; Acetic acid, [[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]-, 2-ethylhexyl ester; Acetic acid, 2-[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]-, 2-ethylhexyl ester; 2-ethylhexyl[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]thio]acetate; Acetic acid, 2-(((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methyl)thio)-, 2-ethylhexyl ester; 2-ethylhexyl(((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methyl)thio)acetate; RefChem:552124; DTXCID60816664; 80387-97-9; (((3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl)methyl)thio)acetic acid 2-ethylhexyl ester; Irganox 1192; EINECS 279-452-8; A6LGK467BT; SCHEMBL3500694; SPDKDTGZSHRXIT-UHFFFAOYSA-N
| 已通报的危害声明 | H317, H412 |
|---|
(((3,5-双(1,1-二甲基乙基)-4-羟基苯基)甲基)硫代)乙酸2-乙基己基酯 · CAS 80387-97-9 · C25H42O3S. UNII A6LGK467BT.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.