methyl 3,5,5-trimethylhexanoate (CAS 71500-39-5) — formula C10H20O2, molecular weight 172.26; category organic chemicals.
| CAS Number | 71500-39-5 |
|---|---|
| Molecular Formula | C10H20O2 |
| Molecular Weight | 172.26 |
| LogP | 3.6 |
| Category | Organic Chemicals |
methyl 3,5,5-trimethylhexanoate is a carbon-based organic compound with CAS registry number 71500-39-5 and molecular formula C10H20O2 (molecular weight 172.26), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 71500-39-5
Its molecular formula C10H20O2 comprises 10 C, 20 H, 2 O atoms.
Also known as: methyl 3,5,5-trimethylhexanoate · 3,5,5-三甲基己酸甲酯
Category: organic chemicals
The CAS registry number of methyl 3,5,5-trimethylhexanoate is 71500-39-5.
Molecular formula C10H20O2, molecular weight 172.26.
It is also registered under: methyl 3,5,5-trimethylhexanoate, 3,5,5-三甲基己酸甲酯.
Category: Organic Chemicals.
Independent reference data for methyl 3,5,5-trimethylhexanoate (CAS 71500-39-5), compiled from public chemistry databases.
| CAS 号 | 71500-39-5 |
|---|---|
| PubChem CID | 13301941 |
| 分子式 | C10H20O2 |
| IUPAC 名称 | methyl 3,5,5-trimethylhexanoate |
| UNII（FDA） | NS00005899 |
| Molecular Weight | 172.26 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 172.146329876 |
| Monoisotopic Mass | 172.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 12 |
methyl 3,5,5-trimethylhexanoate; DTXSID801303738; RefChem:814659; DTXCID301733768; 71500-39-5; Hexanoic acid, 3,5,5-trimethyl-, methyl ester; 3,5,5-trimethylhexanoic acid methyl ester; MFCD23718300; EC 807-032-1; Methyl 355-trimethylhexanoate; SCHEMBL6876974; AKOS017417073; AS-84697; NS00005899; E77778; F849338
| 已通报的危害声明 | H411 (100%) |
|---|
3,5,5-三甲基己酸甲酯 · CAS 71500-39-5 · C10H20O2. UNII NS00005899.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3,5,5-三甲基己酸甲酯