异壬酸异十三酯（CAS 42131-27-1）：分子式 C22H44O2、分子量 340.6。
| CAS号 | 42131-27-1 |
|---|---|
| 分子式 | C22H44O2 |
| 分子量 | 340.6 |
| LogP | 8.9 |
| 应用领域 | Use Classification: Cosmetics -> Skin conditioning、Emollient、General Manufacturing Information: Hexanoic acid、3、5、5-trimethyl-、isotridecyl ester: ACTIVE |
登记用途：Use Classification: Cosmetics -> Skin conditioning、Emollient、General Manufacturing Information: Hexanoic acid、3、5、5-trimethyl-、isotridecyl ester: ACTIVE。
异壬酸异十三酯 是一种化工化合物，登记 CAS 号为 42131-27-1，分子式 C22H44O2（分子量 340.6）。
登记 CAS 号：42131-27-1
其分子式 C22H44O2 由 22 个碳、44 个氢、2 个氧 组成。
别名/同义词：异壬酸异十三酯 · Isotridecyl Isononanoate
异壬酸异十三酯 的 CAS 登记号为 42131-27-1。
分子式 C22H44O2，分子量 340.6。
别名/同义词：异壬酸异十三酯、Isotridecyl Isononanoate。
登记用途：Use Classification: Cosmetics -> Skin conditioning、Emollient、General Manufacturing Information: Hexanoic acid、3、5、5-trimethyl-、isotridecyl ester: ACTIVE。
异壬酸异十三酯（CAS 42131-27-1）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 42131-27-1 |
|---|---|
| PubChem CID | 100993 |
| Molecular formula | C22H44O2 |
| IUPAC name | 11-methyldodecyl 3,5,5-trimethylhexanoate |
| UNII (FDA) | WEF51750MT |
| Molecular Weight | 340.6 |
|---|---|
| XLogP3 | 8.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 16 |
| Exact Mass | 340.334130642 |
| Monoisotopic Mass | 340.334130642 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 24 |
59231-37-7; Isotridecyl 3,5,5-trimethylhexanoate; Wickenol 153; EINECS 261-675-7; Hexanoic acid, 3,5,5-trimethyl-, isotridecyl ester; DTXSID70866751; Isomeric tetramethyl-1-nonyl 3,5,5-trimethyl hexanoate; RefChem:787366; DTXCID70815007; 261-675-7; 11-methyldodecyl 3,5,5-trimethylhexanoate; SCHEMBL8575386; DTXSID00275958; DB-308151; NS00013802; 3,5,5-trimethylhexanoic acid-isotridecyl ester
| Regulatory & Food Contact | CIR / INCI: Skin conditioning; Emollient |
|---|---|
| GHS notification summary | 100% (24 / 24) |
| GHS notification summary | 100% (24 / 24) |
|---|
This chemical does not meet GHS hazard criteria for 100% (24 of 24) of all reports.
Reported as not meeting GHS hazard criteria by 24 of 24 companies. For more detailed information, please visit ECHA C&L website.
Isotridecyl Isononanoate · CAS 42131-27-1 · C22H44O2. UNII WEF51750MT.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: Isotridecyl Isononanoate