Cas no 2386-33-6 (3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid)
2386-33-6 structure
Product Name:3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid
CAS No:2386-33-6
MF:C9H11NO3
MW:181.188542604446
MDL:MFCD00734952
CID:252694
PubChem ID:590679
Update Time:2025-04-19
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid
- 1H-Pyrrole-2-carboxylicacid, 3-acetyl-4,5-dimethyl-
- 4-ACETYL-3,5-DIMETHYL-2-PYRROLECARBOXYLIC ACID
- 3-Acetyl-2-carboxy-4,5-dimethylpyrrol
- 3-Acetyl-4,5-dimethyl-2-pyrrolcarbonsaeure
- 3-acetyl-4,5-dimethyl-2-pyrrole carboxylic acid
- 3-Acetyl-4,5-dimethyl-pyrrol-2-carbonsaeure
- 3-Acetyl-4,5-dimethylpyrrole-2-carboxylic acid
- SB62395
- F30648
- CS-0318270
- Pyrrole-2-carboxylic acid, 3-acetyl-4,5-dimethyl-
- CAA38633
- AKOS001722247
- SCHEMBL2150911
- AS-48386
- 3-acetyl-4, 5-dimethyl-1H-pyrrole-2-carboxylic acid
- FT-0654553
- 3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylicacid
- A816942
- MFCD00734952
- 2386-33-6
- DTXSID80343583
- DTXCID20294661
-
- MDL： MFCD00734952
- Inchi： 1S/C9H11NO3/c1-4-5(2)10-8(9(12)13)7(4)6(3)11/h10H,1-3H3,(H,12,13)
- InChI Key： PPSGKMWFWAXDHT-UHFFFAOYSA-N
- SMILES： O=C(C)C1=C(C(=O)O)NC(C)=C1C
Computed Properties
- Exact Mass: 181.07400
- Monoisotopic Mass: 181.07389321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 239
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 25
- XLogP3: 1
- Topological Polar Surface Area: 70.2?2
Experimental Properties
- Color/Form: Not determined
- Density: 1.255±0.06 g/cm3 (20 oC 760 Torr),
- Melting Point: 204 oC
- Solubility: Slightly soluble (8.9 g/l) (25 o C),
- PSA: 70.16000
- LogP: 1.53230
- Solubility: Not determined
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid Customs Data
- HS CODE：2933990090
- Customs Data：
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A109004833-100g |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 95% | 100g |
$771.26 | 2023-09-02 | |
| Chemenu | CM196901-100g |
3-Acetyl-4,5-dimethylpyrrole-2-carboxylic acid |
2386-33-6 | 95% | 100g |
$736 | 2021-08-05 | |
| CHENG DOU FEI BO YI YAO Technology Co., Ltd. | FC12057-10g |
3-acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 95% | 10g |
$1800 | 2023-09-07 | |
| Fluorochem | 231489-1g |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 95% | 1g |
￡29.00 | 2022-02-28 | |
| abcr | AB461476-1 g |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 1g |
€113.70 | 2023-04-21 | ||
| Chemenu | CM196901-100g |
3-Acetyl-4,5-dimethylpyrrole-2-carboxylic acid |
2386-33-6 | 95%+ | 100g |
$736 | 2023-03-07 | |
| eNovation Chemicals LLC | D963642-100mg |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 95% | 100mg |
$150 | 2024-06-07 | |
| eNovation Chemicals LLC | D963642-250mg |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 95% | 250mg |
$210 | 2024-06-07 | |
| eNovation Chemicals LLC | D963642-1g |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 95% | 1g |
$390 | 2024-06-07 | |
| eNovation Chemicals LLC | D963642-5g |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid |
2386-33-6 | 95% | 5g |
$1140 | 2024-06-07 |
3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid Related Literature
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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