3,4,5-Trimethoxybenzoyl chloride
- Product Name
- 3,4,5-Trimethoxybenzoyl chloride
- CAS No.
- 4521-61-3
- Chemical Name
- 3,4,5-Trimethoxybenzoyl chloride
- Synonyms
- SKL1322;AKOS BBS-00003922;Troxipide Impurity 2;Trimethylgalloyl chloride;Tri-O-methylgalloyl chloride;3,4,5-trimethoxy-benzoylchlorid;3,4,5-TRIMETHOXYBENZOYL CHLORIDE;Benzoyl chloride, 3,4,5-trimethoxy-;3,4,5-Trimethoxybenzoic acid chloride;sulfuric acid [(8R,9S,13S,14S,16R,17R)-3,16-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ester
- CBNumber
- CB7479180
- Molecular Formula
- C10H11ClO4
- Formula Weight
- 230.64
- MOL File
- 4521-61-3.mol
3,4,5-Trimethoxybenzoyl chloride Property
- Melting point:
- 81-84 °C (lit.)
- Boiling point:
- 185 °C/18 mmHg (lit.)
- Density
- 1,214 g/cm3
- refractive index
- 1.4571 (estimate)
- Flash point:
- 185°C/18mm
- storage temp.
- 2-8°C
- solubility
- soluble in Toluene
- form
- powder to crystal
- color
- White to Orange to Green
- Sensitive
- Moisture Sensitive
- BRN
- 403117
- InChI
- 1S/C10H11ClO4/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-5H,1-3H3
- InChIKey
- BUHYMJLFRZAFBF-UHFFFAOYSA-N
- SMILES
- COc1cc(cc(OC)c1OC)C(Cl)=O
- LogP
- 2.400 (est)
- CAS DataBase Reference
- 4521-61-3(CAS DataBase Reference)
- NIST Chemistry Reference
- 3,4,5-Trimethoxybenzoyl chloride(4521-61-3)
- EPA Substance Registry System
- Benzoyl chloride, 3,4,5-trimethoxy- (4521-61-3)
Safety
- Hazard Codes
- C
- Risk Statements
- 14-34-37
- Safety Statements
- 26-36/37/39-45
- RIDADR
- UN 3261 8/PG 2
- WGK Germany
- 1
- F
- 9-21
- TSCA
- TSCA listed
- HazardClass
- 8
- PackingGroup
- II
- HS Code
- 29189900
- Storage Class
- 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- Skin Corr. 1B
STOT SE 3
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H314Causes severe skin burns and eye damage
H335May cause respiratory irritation
- Precautionary statements
-
P260Do not breathe dust/fume/gas/mist/vapours/spray.
P271Use only outdoors or in a well-ventilated area.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- T69809
- Product name
- 3,4,5-Trimethoxybenzoyl chloride
- Purity
- 98%
- Packaging
- 25g
- Price
- $142.8
- Updated
- 2025/07/31
- Product number
- T1842
- Product name
- 3,4,5-Trimethoxybenzoyl Chloride
- Purity
- >97.0%(T)
- Packaging
- 25g
- Price
- $89
- Updated
- 2025/07/31
- Product number
- T796225
- Product name
- 3,4,5-Trimethoxybenzoyl chloride
- Packaging
- 5g
- Price
- $65
- Updated
- 2021/12/16
- Product number
- L417
- Product name
- 3,4,5-Trimethoxybenzoyl chloride
- Packaging
- 5g
- Price
- $29
- Updated
- 2021/12/16
- Product number
- 62414
- Product name
- 3,4,5-Trimethoxybenzoyl chloride
- Packaging
- 5G
- Price
- $565
- Updated
- 2021/12/16
3,4,5-Trimethoxybenzoyl chloride Chemical Properties,Usage,Production
Uses
3,4,5-Trimethoxybenzoyl Chloride is used as a reagent in the synthesis of 2-methyl-8-(3,4,5-trimethoxybenzamido)-1,2,3,4-tetrahydroisoquinoline and its analogs which display great antihypertensive activity.
Synthesis
118-41-2
4521-61-3
The general procedure for the synthesis of 3,4,5-trimethoxybenzoyl chloride from 3,4,5-trimethoxybenzoic acid was as follows: thionyl chloride (13.7 mL, 189 mmol) was added dropwise to a solution of CHCl3 (30 mL) containing 3,4,5-trimethoxybenzoic acid (8.00 g, 37.7 mmol). After the dropwise addition, the reaction mixture was heated to reflux and maintained for 4 hours. Upon completion of the reaction, the mixture was cooled to room temperature. Subsequently, the solvent and excess thionyl chloride were removed by distillation under reduced pressure to afford 3,4,5-trimethoxybenzoyl chloride as a colorless oil in quantitative yield. The obtained product can be used in the subsequent reaction without further purification. The characteristic absorption peaks of the infrared spectrum (NaCl) were: νmax/cm-1 2970, 2944, 1750, 1590, 1457, 1415, 1130, 1128.
References
[1] Bioorganic and Medicinal Chemistry Letters, 2006, vol. 16, # 22, p. 5864 - 5869
[2] Tetrahedron, 2011, vol. 67, # 25, p. 4601 - 4611
[3] Bioorganic and Medicinal Chemistry, 2011, vol. 19, # 20, p. 6042 - 6054
[4] Letters in Drug Design and Discovery, 2018, vol. 15, # 12, p. 1319 - 1328
[5] Bulletin of the Chemical Society of Japan, 2012, vol. 85, # 2, p. 236 - 244
3,4,5-Trimethoxybenzoyl chloride Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 3,4,5-Trimethoxybenzoyl chloride manufacturers
- Product
- 3,4,5-Trimethoxybenzoyl chloride 4521-61-3
- Price
- US $20.00-15.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 50MT/month
- Release date
- 2024-03-27
- Product
- 345-Trimethoxybenzoyl chloride 4521-61-3
- Price
- US $25.00-11.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 200000KG
- Release date
- 2024-08-12
- Product
- 3,4,5-Trimethoxybenzoyl chloride 4521-61-3
- Price
- US $0.00/Kg/Drum
- Min. Order
- 300KG
- Purity
- 98.0%
- Supply Ability
- 50tons/year
- Release date
- 2020-11-26