Cas no 62128-30-7 (3-benzoyl-1-methyl-1H-pyrrole)
3-Benzoyl-1-methyl-1H-pyrrole is a heterocyclic compound featuring a benzoyl group attached to the 3-position of a 1-methylpyrrole scaffold. This structure imparts unique reactivity and functional versatility, making it valuable in organic synthesis and pharmaceutical intermediates. The compound’s electron-rich pyrrole ring enhances its utility in nucleophilic substitution and cross-coupling reactions, while the benzoyl moiety provides a handle for further derivatization. Its stability under standard conditions and compatibility with a range of reagents make it a practical choice for constructing complex molecular architectures. The methyl group at the 1-position further improves solubility and handling in synthetic workflows.
3-benzoyl-1-methyl-1H-pyrrole structure
Product Name:3-benzoyl-1-methyl-1H-pyrrole
CAS No:62128-30-7
MF:C12H11NO
MW:185.221843004227
MDL:MFCD17010003
CID:457125
PubChem ID:10856186
Update Time:2025-05-20
3-benzoyl-1-methyl-1H-pyrrole Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (1-methyl-1H-pyrrol-3-yl)phenyl-
- (1-methylpyrrol-3-yl)-phenylmethanone
- 3-benzoyl-1-methyl-1H-pyrrole
- DTXSID20446022
- AKOS022536510
- 62128-30-7
- (1-Methyl-1H-pyrrol-3-yl)(phenyl)methanone
- CS-0454307
- (1-METHYL-PYRROL-3-YL)(PHENYL)METHANONE
- SCHEMBL11728665
- MB69076
-
- MDL： MFCD17010003
- Inchi： 1S/C12H11NO/c1-13-8-7-11(9-13)12(14)10-5-3-2-4-6-10/h2-9H,1H3
- InChI Key： SUBYPQWCOVUWJI-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1)C1C=CN(C)C=1
Computed Properties
- Exact Mass: 185.08413
- Monoisotopic Mass: 185.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 208
- 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
- XLogP3: 2
- Topological Polar Surface Area: 22?2
Experimental Properties
- Density: 1.05±0.1 g/cm3 (20 oC 760 Torr),
- Melting Point: 90-93 oC (methanol )
- Solubility: Very slightly soluble (0.3 g/l) (25 o C),
- PSA: 22
3-benzoyl-1-methyl-1H-pyrrole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A109004233-1g |
(1-Methyl-1H-pyrrol-3-yl)(phenyl)methanone |
62128-30-7 | 95% | 1g |
$514.80 | 2023-09-01 | |
| Chemenu | CM196684-1g |
(1-methyl-1H-pyrrol-3-yl)(phenyl)methanone |
62128-30-7 | 95% | 1g |
$574 | 2021-08-05 | |
| Chemenu | CM196684-1g |
(1-methyl-1H-pyrrol-3-yl)(phenyl)methanone |
62128-30-7 | 95% | 1g |
$*** | 2023-05-30 | |
| eNovation Chemicals LLC | Y0990654-5g |
(1-methyl-1H-pyrrol-3-yl)(phenyl)methanone |
62128-30-7 | 95% | 5g |
$1600 | 2025-02-19 | |
| eNovation Chemicals LLC | Y0990654-5g |
(1-methyl-1H-pyrrol-3-yl)(phenyl)methanone |
62128-30-7 | 95% | 5g |
$1600 | 2025-02-18 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1524974-1g |
(1-Methyl-1H-pyrrol-3-yl)(phenyl)methanone |
62128-30-7 | 98% | 1g |
￥2943.00 | 2024-05-06 | |
| eNovation Chemicals LLC | D624712-1g |
3-benzoyl-1-methyl-1H-pyrrole |
62128-30-7 | 95% | 1g |
$505 | 2025-02-22 | |
| eNovation Chemicals LLC | D624712-1G |
3-benzoyl-1-methyl-1H-pyrrole |
62128-30-7 | 95% | 1g |
$505 | 2024-07-21 | |
| eNovation Chemicals LLC | Y0990654-5g |
(1-methyl-1H-pyrrol-3-yl)(phenyl)methanone |
62128-30-7 | 95% | 5g |
$1600 | 2024-08-02 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBSL0015-1G |
3-benzoyl-1-methyl-1H-pyrrole |
62128-30-7 | 95% | 1g |
￥ 2,943.00 | 2023-03-19 |
3-benzoyl-1-methyl-1H-pyrrole Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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