4-methylcatechol (CAS 452-86-8) — formula C7H8O2, molecular weight 124.14; category organic chemicals.
| CAS Number | 452-86-8 |
|---|---|
| Molecular Formula | C7H8O2 |
| Molecular Weight | 124.14 |
| Melting Point | 65 |
| Boiling Point | 251 |
| LogP | 1.37 |
| Category | Organic Chemicals |
4-methylcatechol is a carbon-based organic compound with CAS registry number 452-86-8 and molecular formula C7H8O2 (molecular weight 124.14), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 452-86-8
Its molecular formula C7H8O2 comprises 7 C, 8 H, 2 O atoms.
Also known as: 4-methylcatechol · 4-甲基儿茶酚
Category: organic chemicals
The CAS registry number of 4-methylcatechol is 452-86-8.
Molecular formula C7H8O2, molecular weight 124.14.
It is also registered under: 4-methylcatechol, 4-甲基儿茶酚.
Category: Organic Chemicals.
Independent reference data for 4-methylcatechol (CAS 452-86-8), compiled from public chemistry databases.
| CAS Registry Number | 452-86-8 |
|---|---|
| PubChem CID | 9958 |
| Molecular formula | C7H8O2 |
| IUPAC name | 4-methylbenzene-1,2-diol |
| UNII (FDA) | 12GLI7JGB3 |
| Molecular Weight | 124.14 |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 124.052429494 |
| Monoisotopic Mass | 124.052429494 |
| Topological Polar Surface Area | 40.5 |
| Heavy Atom Count | 9 |
| Boiling Point | 251 |
|---|---|
| Melting Point | 65 |
| Melting Point | 65 °C |
| Vapor Pressure | 0.0028 [mmHg] |
| LogP | 1.37 |
| Ionization Efficiency | -0.28 |
| Ionization Efficiency | 2.7 |
| Ionization Efficiency | MeCN (80%) |
| Ionization Efficiency | DOI:10.1038/s41598-020-62573-z |
| Collision Cross Section | 121.5 Ų [M-H]- |
4-Methylcatechol; 452-86-8; 4-methylbenzene-1,2-diol; 3,4-Dihydroxytoluene; Homocatechol; 4-Methyl-1,2-benzenediol; Homopyrocatechol; p-Methylcatechol; 1,2-Benzenediol, 4-methyl-; Toluene-3,4-diol; 1,2-Dihydroxy-4-methylbenzene; p-Methylpyrocatechol; 4-Methyl-1,2-dihydroxybenzene; Pyrocatechol, 4-methyl-; 2-Hydroxy-4-methylphenol; DTXSID5020861
| Reported hazard statements | H302 (11.9%), H312 (10.2%), H315 (100%), H319 (100%), H335 (98.3%) |
|---|
H302 (11.9%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (10.2%): Harmful in contact with skin [Warning Acute toxicity, dermal]
4-methylcatechol · CAS 452-86-8 · C7H8O2. UNII 12GLI7JGB3. Boiling Point: 251; Melting Point: 65; Melting Point: 65 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-甲基儿茶酚