Nonoic acid (CAS 112-05-0) — formula C9H18O2, molecular weight 158.13 g/mol.
Nonoic acid is a chemical compound with CAS registry number 112-05-0 and molecular formula C9H18O2 (molecular weight 158.13 g/mol).
CAS number: 112-05-0
Its molecular formula C9H18O2 comprises 9 C, 18 H, 2 O atoms.
Also known as: Nonoic acid · Nonanoic acid
The CAS registry number of Nonoic acid is 112-05-0.
Molecular formula C9H18O2, molecular weight 158.13 g/mol.
It is also registered under: Nonoic acid, Nonanoic acid.
Public-database records for Nonoic acid (CAS 112-05-0), reproduced here for independent cross-checking.
| 已通报的危害声明 | H315, H319, H412, H314 (87.4%), H318 (19.1%), H336, H402, H411 |
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| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT FDA Cumulative Estimated Daily Intake (CEDI): FCS FDA 21 CFR 中列出的食品接触物质清单:FCS Flavoring Agents FLAVOURING_AGENT: Flavouring Agent |
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| 沸点 | 254.5 °C |
|---|---|
| 沸点 | Boiling point = 255.6 °C |
| 沸点 | 254 °C |
| 沸点 | 254 °C @760 [mm Hg] |
| 熔点 | 12.4 °C |
| 熔点 | 12.3 °C |
| 闪点 | 133 °C (open cup) |
| 溶解度 | In water, 284 mg/L at 30 °C |
| 溶解度 | 0.284 mg/mL |
| 密度 | 0.9052 g/cu cm at 20 °C |
| CAS 号 | 112-05-0 |
|---|---|
| PubChem CID | 8158 |
| 分子式 | C9H18O2 |
| 分子量 | 158.13 g/mol |
| IUPAC 名称 | nonanoic acid |
| InChIKey | FBUKVWPVBMHYJY-UHFFFAOYSA-N |
| UNII(FDA) | 97SEH7577T |
| ChEBI 编号 | CHEBI:29019 |
| FEMA 编号 | 2784 |
| JECFA 编号 | 102 |
NONANOIC ACID; Pelargonic acid; 112-05-0; n-Nonanoic acid; Nonoic acid; Nonylic acid; Pelargic acid; 1-Octanecarboxylic acid; n-Nonylic acid; n-Nonoic acid; Pelargon; Hexacid C-9; Cirrasol 185A; Emfac 1202; 1-Octanecarboxyic acid; FEMA No. 2784
| 分子量 | 158.24 |
|---|---|
| XLogP3 | 3.5 |
| 氢键供体数 | 1 |
| 氢键受体数 | 2 |
| 可旋转键数 | 7 |
| 精确质量 | 158.130679813 |
| 单同位素质量 | 158.130679813 |
| 拓扑极性表面积 | 37.3 |
| 重原子数 | 11 |
| 形式电荷 | 0 |
正壬酸 的 CAS 号为 112-05-0,分子式 C9H18O2,分子量 158.13 g/mol。 UNII 97SEH7577T; ChEBI 29019; InChIKey FBUKVWPVBMHYJY-UHFFFAOYSA-N. 沸点: 254.5 °C; 沸点: Boiling point = 255.6 °C; 沸点: 254 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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