Cas no 23754-45-2 (4-(Methylamino)carbonylbenzoic Acid)
4-(Methylamino)carbonylbenzoic Acid is a benzoic acid derivative featuring a methylaminocarbonyl substituent at the para position. This compound is of interest in organic synthesis and pharmaceutical research due to its bifunctional reactivity, combining a carboxylic acid group and an amide moiety. The carboxylic acid allows for further derivatization via esterification or amidation, while the methylaminocarbonyl group contributes to hydrogen-bonding interactions, enhancing molecular recognition properties. Its structural features make it a versatile intermediate for designing bioactive molecules or functional materials. The compound is typically handled under standard laboratory conditions, requiring protection from moisture to maintain stability. Its purity and well-defined structure support reproducible results in synthetic applications.
23754-45-2 structure
Product Name:4-(Methylamino)carbonylbenzoic Acid
CAS No:23754-45-2
MF:C9H9NO3
MW:179.172662496567
MDL:MFCD10688269
CID:1075238
PubChem ID:506058
Update Time:2025-05-27
4-(Methylamino)carbonylbenzoic Acid Chemical and Physical Properties
Names and Identifiers
-
- 4-[(Methylamino)carbonyl]benzoic acid
- 4-(Methylaminocarbonyl)benzoic acid
- N-Methyl-terephthalamic acid
- MFCD10688269
- BS-16274
- CHEMBL131837
- SCHEMBL479724
- 4-(methylcarbamoyl)benzoic acid
- ZYTCRZMJZJPYEG-UHFFFAOYSA-N
- 4-(methylcarbamoyl)benzoicacid
- D83269
- Benzoic acid, 4-[(methylamino)carbonyl]-
- DB-357600
- 4-[(methylamino)carbonyl]benzoic acid, AldrichCPR
- YAA75445
- 23754-45-2
- SY287785
- AKOS009498120
- CS-0151059
- 4-(Methylamino)carbonylbenzoic Acid
-
- MDL： MFCD10688269
- Inchi： 1S/C9H9NO3/c1-10-8(11)6-2-4-7(5-3-6)9(12)13/h2-5H,1H3,(H,10,11)(H,12,13)
- InChI Key： ZYTCRZMJZJPYEG-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(C(=O)O)=CC=1)NC
Computed Properties
- Exact Mass: 179.05827
- Monoisotopic Mass: 179.058243149g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 207
- 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: 0.7
- Topological Polar Surface Area: 66.4?2
Experimental Properties
- PSA: 66.4
4-(Methylamino)carbonylbenzoic Acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Matrix Scientific | 032271-500g |
4-[(Methylamino)carbonyl]benzoic acid |
23754-45-2 | 500g |
$175.00 | 2023-09-11 | ||
| Matrix Scientific | 032271-1g |
4-[(Methylamino)carbonyl]benzoic acid |
23754-45-2 | 1g |
$270.00 | 2023-09-11 | ||
| Fluorochem | 046430-1g |
4-[(Methylamino)carbonyl]benzoic acid |
23754-45-2 | 95%+ | 1g |
￡167.00 | 2021-06-28 | |
| Fluorochem | 046430-5g |
4-[(Methylamino)carbonyl]benzoic acid |
23754-45-2 | 95%+ | 5g |
￡533.00 | 2021-06-28 | |
| Fluorochem | 046430-10g |
4-[(Methylamino)carbonyl]benzoic acid |
23754-45-2 | 95%+ | 10g |
￡921.00 | 2021-06-28 | |
| TRC | M223620-50mg |
4-[(Methylamino)carbonyl]benzoic Acid |
23754-45-2 | 50mg |
$ 50.00 | 2022-06-02 | ||
| TRC | M223620-100mg |
4-[(Methylamino)carbonyl]benzoic Acid |
23754-45-2 | 100mg |
$ 70.00 | 2022-06-02 | ||
| TRC | M223620-500mg |
4-[(Methylamino)carbonyl]benzoic Acid |
23754-45-2 | 500mg |
$ 275.00 | 2022-06-02 | ||
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X18905-5g |
4-(Methylcarbamoyl)benzoic acid |
23754-45-2 | 96% | 5g |
￥2550.0 | 2024-07-18 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X18905-250mg |
4-(Methylcarbamoyl)benzoic acid |
23754-45-2 | 96% | 250mg |
￥307.0 | 2024-07-18 |
4-(Methylamino)carbonylbenzoic Acid Related Literature
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
-
Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
-
Ying Li,Weirong Yao,Yunfei Xie,Renjun Pei RSC Adv., 2015,5, 98724-98729
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