3-Chloro-2-methylbenzoic acid
Catalog No: FT-0636511
CAS No: 7499-08-3
- Molecular Formula: 170.59
- Formula Weight: C8H7ClO2
- Inchl Key: HXGHMCLCSPQMOR-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H7ClO2/c1-5-6(8(10)11)3-2-4-7(5)9/h2-4H,1H3,(H,10,11)
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| FW: | 170.593 |
|---|---|
| CAS: | 7499-08-3 |
| Flash_Point: | 129.7±21.8 °C |
| MF: | C8H7ClO2 |
| Symbol: | Warning |
| Bolling_Point: | 290.9±20.0 °C at 760 mmHg |
| Melting_Point: | 163-166 °C(lit.) |
| Product_Name: | 3-Chloro-2-methylbenzoic acid |
| Density: | 1.3±0.1 g/cm3 |
| FW: | 170.593 |
|---|---|
| MF: | C8H7ClO2 |
| Refractive_Index: | 1.573 |
| Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
| Bolling_Point: | 290.9±20.0 °C at 760 mmHg |
| Exact_Mass: | 170.013458 |
| PSA: | 37.30000 |
| Computational_Chemistry: | ['1 . XlogP 24 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 1 ', '5 . TPSA 373 ', '6 . Heavy Atom Count 11 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 158 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1'] |
| Molecular_Structure: | ['1 . Molar refractive index 4290 ', '2 . Molar volume （m3/mol）1301 ', '3 . Parachor （902K）3429 ', '4 . Surface tension 481 ', '5 . Polarizability 1700'] |
| LogP: | 3.36 |
| Melting_Point: | 163-166 °C(lit.) |
| Flash_Point: | 129.7±21.8 °C |
| Density: | 1.3±0.1 g/cm3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
|---|---|
| RTECS: | XU1645000 |
| HS_Code: | 2916399090 |
| Symbol: | Warning |
| Risk_Statements(EU): | R36/37/38 |
| WGK_Germany: | 3 |
| Warning_Statement: | P261-P305 + P351 + P338 |
| Safety_Statements: | H315-H319-H335 |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi: Irritant; |
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