o-Methoxybenzaldehyde (CAS 135-02-4) — formula C8H8O2, molecular weight 136.05 g/mol.
o-Methoxybenzaldehyde is a chemical compound with CAS registry number 135-02-4 and molecular formula C8H8O2 (molecular weight 136.05 g/mol).
CAS number: 135-02-4
Its molecular formula C8H8O2 comprises 8 C, 8 H, 2 O atoms.
Also known as: o-Methoxybenzaldehyde · o-Anisaldehyde
The CAS registry number of o-Methoxybenzaldehyde is 135-02-4.
Molecular formula C8H8O2, molecular weight 136.05 g/mol.
It is also registered under: o-Methoxybenzaldehyde, o-Anisaldehyde.
Public-database records for o-Methoxybenzaldehyde (CAS 135-02-4), reproduced here for independent cross-checking.
| GHS notification summary | 0.2% (3 / 1457) |
|---|---|
| Reported hazard statements | H315 (99.8%), H319 (99.8%), H335 (99.5%) |
This chemical does not meet GHS hazard criteria for 0.2% (3 of 1457) of reports.
H315 (99.8%): Causes skin irritation [Warning Skin corrosion/irritation]
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 0.2% (3 / 1457) |
| 沸点 | 238.00 °C. @ 760.00 mm Hg |
|---|---|
| 熔点 | 39 °C |
| 蒸气压 | 0.12 [mmHg] |
| LogP | 1.72 |
| Ionization Efficiency | 1.18 |
| Ionization Efficiency | 2.7 |
| Ionization Efficiency | MeCN (80%) |
| Ionization Efficiency | DOI:10.1038/s41598-020-62573-z |
| CAS Registry Number | 135-02-4 |
|---|---|
| PubChem CID | 8658 |
| 分子式 | C8H8O2 |
| 分子量 | 136.05 g/mol |
| IUPAC 名称 | 2-methoxybenzaldehyde |
| InChIKey | PKZJLOCLABXVMC-UHFFFAOYSA-N |
| UNII(FDA) | 7CP821WF2W |
| ChEBI 编号 | CHEBI:172139 |
| FEMA 编号 | 4077 |
| JECFA 编号 | 2062 |
2-METHOXYBENZALDEHYDE; o-Anisaldehyde; Benzaldehyde, 2-methoxy-; o-Methoxybenzaldehyde; 2-methoxy-benzaldehyde; Formylanisole, o-; DTXSID1051690; EINECS 205-171-7; UNII-7CP821WF2W; NSC 58960; BRN 0606301; 7CP821WF2W; o-methoxy benzaldehyde; o-methoxy-benzaldehyde; O-Anisaldehyde, 8CI; AI3-01375
| 分子量 | 136.15 |
|---|---|
| XLogP3 | 1.7 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 2 |
| 精确质量 | 136.052429494 |
| 单同位素质量 | 136.052429494 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 10 |
| 形式电荷 | 0 |
o-Methoxybenzaldehyde is identified by CAS 135-02-4, molecular formula C8H8O2 and molecular weight 136.05 g/mol. UNII 7CP821WF2W; ChEBI 172139; InChIKey PKZJLOCLABXVMC-UHFFFAOYSA-N. 沸点: 238.00 °C. @ 760.00 mm Hg; 熔点: 39 °C; 蒸气压: 0.12 [mmHg].
Source: PubChem / Wikidata; the batch COA governs where values differ.
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