4,5-DIFLUORO-2-METHYLBENZOIC ACID (CAS 183237-86-7) — formula C8H6F2O2, molecular weight 172.13; category organic chemicals.
4,5-DIFLUORO-2-METHYLBENZOIC ACID is a carbon-based organic compound with CAS registry number 183237-86-7 and molecular formula C8H6F2O2 (molecular weight 172.13), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 183237-86-7
Its molecular formula C8H6F2O2 comprises 8 C, 6 H, 2 F, 2 O atoms.
Also known as: 4,5-DIFLUORO-2-METHYLBENZOIC ACID
Category: organic chemicals
The CAS registry number of 4,5-DIFLUORO-2-METHYLBENZOIC ACID is 183237-86-7.
Molecular formula C8H6F2O2, molecular weight 172.13.
It is also registered under: 4,5-DIFLUORO-2-METHYLBENZOIC ACID.
Category: Organic Chemicals.
Public-database records for 4,5-DIFLUORO-2-METHYLBENZOIC ACID (CAS 183237-86-7), reproduced here for independent cross-checking.
| Reported hazard statements | H302 (25%), H315 (87.5%), H319 (87.5%), H335 (87.5%) |
|---|
H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (87.5%): Causes skin irritation [Warning Skin corrosion/irritation]
| CAS Registry Number | 183237-86-7 |
|---|---|
| PubChem CID | 17760483 |
| 分子式 | C8H6F2O2 |
| IUPAC 名称 | 4,5-difluoro-2-methylbenzoic acid |
4,5-Difluoro-2-methylbenzoic acid; 183237-86-7; DTXSID50590865; RefChem:96465; DTXCID40541629; 630-277-9; 4,5-Difluoro-2-methylbenzoicacid; MFCD08062377; 3,4-Difluoro-6-methylbenzoic acid; Benzoic acid, 4,5-difluoro-2-methyl-; SCHEMBL27887; AKOS005257585; 4,5-difluoro-2-methyl-benzoic acid; BBL101235; SBB065043; STL555031
| 分子量 | 172.13 |
|---|---|
| XLogP3 | 2 |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 1 |
| 精确质量 | 172.03358575 |
| 单同位素质量 | 172.03358575 |
| 拓扑极性表面积 | 37.3 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
4,5-DIFLUORO-2-METHYLBENZOIC ACID · CAS 183237-86-7 · C8H6F2O2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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