4-Coumaric acid (CAS 7400-08-0) — formula C9H8O3, molecular weight 164.16.
4-Coumaric acid is a chemical compound with CAS registry number 7400-08-0 and molecular formula C9H8O3 (molecular weight 164.16).
CAS number: 7400-08-0
Its molecular formula C9H8O3 comprises 9 C, 8 H, 3 O atoms.
Also known as: 4-Coumaric acid · p-Hydroxycinnamic acid
The CAS registry number of 4-Coumaric acid is 7400-08-0.
Molecular formula C9H8O3, molecular weight 164.16.
It is also registered under: 4-Coumaric acid, p-Hydroxycinnamic acid.
Public-database records for 4-Coumaric acid (CAS 7400-08-0), reproduced here for independent cross-checking.
| 已通报的危害声明 | H301, H311 (63.6%), H314 (68.2%), H315 (31.8%), H317 (68.2%), H318 (63.6%), H319 (31.8%), H335 (97.7%) |
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| 法规与食品接触 | CIR / INCI: Skin conditioning |
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| CAS 号 | 7400-08-0 |
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| PubChem CID | 322 |
| 分子式 | C9H8O3 |
| 分子量 | 164.05 g/mol |
| IUPAC 名称 | 3-(4-hydroxyphenyl)prop-2-enoic acid |
| InChIKey | NGSWKAQJJWESNS-UHFFFAOYSA-N |
| UNII（FDA） | NS00004354 |
| ChEBI 编号 | CHEBI:36090 |
DTXSID6064660; CHEBI:36090; 3-(4-hydroxyphenyl)prop-2-enoic acid; RefChem:1070546; DTXCID1047605; 4-Coumaric acid; p-Hydroxycinnamic acid; 7400-08-0; p-Hydroxy-cinnamic acid; 4-trans-4-Hydroxycinnamic acid; parahydroxycinnamic acid; p-hydroxy cinnamic acid; SODIUM2,4-PENTANEDIONATE; Alkaline ceramidase; 2-Propenoic acid, 3-(4-hydroxyphenyl)-, (2Z)-; 4hydroxycinnamic acid
| 分子量 | 164.16 |
|---|---|
| XLogP3 | 1.5 |
| 氢键供体数 | 2 |
| 氢键受体数 | 3 |
| 可旋转键数 | 2 |
| 精确质量 | 164.047344113 |
| 单同位素质量 | 164.047344113 |
| 拓扑极性表面积 | 57.5 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
p-Hydroxycinnamic acid 的 CAS 号为 7400-08-0，分子式 C9H8O3，分子量 164.05 g/mol。 UNII NS00004354; ChEBI 36090; InChIKey NGSWKAQJJWESNS-UHFFFAOYSA-N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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