Calcium Isocaprylate (CAS 136-51-6) — formula C16H30CaO4, molecular weight 326.48; category chemical.
Calcium Isocaprylate is a chemical compound with CAS registry number 136-51-6 and molecular formula C16H30CaO4 (molecular weight 326.48), belonging to the chemical segment of chemical raw materials.
CAS number: 136-51-6
Its molecular formula C16H30CaO4 comprises 16 C, 30 H, 1 Ca, 4 O atoms.
Also known as: Calcium Isocaprylate · Calcium 2-ethylcaproate;Calcium 2-ethylhexanoate
Category: chemical
The CAS registry number of Calcium Isocaprylate is 136-51-6.
Molecular formula C16H30CaO4, molecular weight 326.48.
It is also registered under: Calcium Isocaprylate, Calcium 2-ethylcaproate;Calcium 2-ethylhexanoate.
Category: Main Products.
Public-database records for Calcium Isocaprylate (CAS 136-51-6), reproduced here for independent cross-checking.
| GHS notification summary | 3.2% (17 / 532) |
|---|---|
| Reported hazard statements | H226 (33.1%), H302 (55.3%), H315 (19.5%), H317 (33.3%), H318 (32.9%), H319 (19%), H334 (33.1%), H335 (18.8%) |
This chemical does not meet GHS hazard criteria for 3.2% (17 of 532) of reports.
H226 (33.1%): Flammable liquid and vapor [Warning Flammable liquids]
| Regulatory & Food Contact | FDA Inventory of Food Contact Substances Listed in 21 CFR: FCS |
|---|---|
| GHS notification summary | 3.2% (17 / 532) |
| 蒸气压 | 0.00000086 [mmHg] |
|---|
| CAS Registry Number | 136-51-6 |
|---|---|
| PubChem CID | 61082 |
| 分子式 | C16H30CaO4 |
| IUPAC 名称 | calcium bis(2-ethylhexanoate) |
| UNII（FDA） | 4UT7R68TMI |
Calcium 2-ethylhexanoate; 136-51-6; Calcium 2-ethylhexoate; Octope Ca; Calcium Hex-Cem; CALCIUM BIS(2-ETHYLHEXANOATE); Nikka Octhix Calcium; DTXSID5027063; Hexanoic acid, 2-ethyl-, calcium salt; EINECS 205-249-0; 4UT7R68TMI; NUSA CA; 2-Ethylhexanoic acid calcium salt; Hexanoic acid, 2-ethyl-, calcium salt (2:1); DTXCID707063; OCTA-SOLIGEN CALCIUM 7HS
| 分子量 | 326.48 |
|---|---|
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 8 |
| 精确质量 | 326.1770003 |
| 单同位素质量 | 326.1770003 |
| 拓扑极性表面积 | 80.3 |
| 重原子数 | 21 |
| 形式电荷 | 0 |
| 复杂度 | 93.9 |
Calcium 2-ethylcaproate;Calcium 2-ethylhexanoate · CAS 136-51-6 · C16H30CaO4. UNII 4UT7R68TMI. 蒸气压: 0.00000086 [mmHg].
Source: PubChem / Wikidata; the batch COA governs where values differ.
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