CAS Number2019-34-3
Synonyms3-(p-chlorophenyl)propionic acid; 3-(4-chlorophenyl)propionoic acid; p-Chlorohydrocinnamic acid; 3-(4-Chlorophenyl)propanoic acid; Benzenepropanoic acid,4-chloro; 3-(p-Chlorophenyl)-propanoic acid; 4-Chloro-benzenepropanoic acid; 4-chlorophenylpropionic acid; 3-(4-Chloro-phenyl)-propionic acid; MFCD00016555
Molecular FormulaClC6H4CH2CH2CO2H
Molecular Weight184.62
Purity97%
Density1.3±0.1 g/cm3
Boiling Point306.6±17.0 °C at 760 mmHg
Melting Point127-131 °C (lit.)
Appearancesolid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 2019-34-3 |
| Catalog No. | 2A-9005681 |
| Chinese Name | 3-(4-氯苯基)丙酸 |
| Synonyms | 3-(p-chlorophenyl)propionic acid; 3-(4-chlorophenyl)propionoic acid; p-Chlorohydrocinnamic acid; 3-(4-Chlorophenyl)propanoic acid; Benzenepropanoic acid,4-chloro; 3-(p-Chlorophenyl)-propanoic acid; 4-Chloro-benzenepropanoic acid; 4-chlorophenylpropionic acid; 3-(4-Chloro-phenyl)-propionic acid; MFCD00016555 |
| Molecular Formula | ClC6H4CH2CH2CO2H |
| Molecular Weight | 184.62 |
| Purity | 97 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 306.6±17.0 °C at 760 mmHg |
| Melting Point | 127-131 °C (lit.) |
| Appearance | solid |
| Storage Condition | Keep the receptacle sealed, stored in a cool, dry |
| HTC | 2916399090 |
| PubChem ID | 24883707 |
| MDL Number | MFCD00016555 |
| SMILES | OC(=O)CCc1ccc(Cl)cc1 |
| InChI | 1S/C9H9ClO2/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2,(H,11,12) |
| InChI Key | BBSLOKZINKEUCR-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| MSDS | msds/5681_1_2019_34_3.pdf |
| Use of | health and chemical hazard data given on this sheet. Storage:Store in closed vessels. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data Melting point:No data Flash point:No data Molecular weight: 184.6 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, hydrogen chloride. Section11. Toxicological information Section12. Ecological information Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION Safety Information GHS05, GHS07 Signal Word Danger Hazard Statements H302-H318 Precautionary Statements P280-P305 + P351 + P338 Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves Hazard Codes Xn:Harmful; Risk Phrases R22;R41 RIDADR NONH for all modes of transport WGK Germany 2 HS Code 2916399090 Synthetic Route 3-(4-Chlorophen... 3-(4-Chlorophen... Literature: Pearson, Anthony J.; Lee, Kieseung Journal of Organic Chemistry, 1994 , vol. 59, # 9 p. 2304 - 2313 3-(4-Chlorophen... Methyl 3-phenyl... 3-(4-Chlorophen... Literature: Tetrahedron Letters, , vol. 54, # 42 p. 5690 - 5694 Meldrumic acid 4-Chlorobenzald... 3-(4-Chlorophen... Literature: Griebenow, Nils; Flessner, Timo; Buchmueller, Anja; Raabe, Martin; Bischoff, Hilmar; Kolkhof, Peter Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 8 p. 2554 - 2558 Precursor & DownStream Precursor 10 CAS#:1615-02-7 3-(4-Chlorophen... CAS#:67-56-1 CAS#:2033-24-1 Meldrumic acid CAS#:104-88-1 4-Chlorobenzaldehyde DownStream 10 CAS#:3506-75-0 2-Butanone,4-(4... CAS#:6282-88-8 3-(4-chlorophen... CAS#:75677-02-0 3-(4-chlorophen... CAS#:57292-44-1 Boc-D-4-Chlorophe |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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