Cas no 40149-67-5 (1,4-dimethyl 2-aminobutanedioate)
1,4-Dimethyl 2-aminobutanedioate is a diester derivative of aspartic acid, commonly utilized as an intermediate in organic synthesis and pharmaceutical applications. Its structure features both an amino group and ester functionalities, enabling versatile reactivity in peptide coupling, chiral synthesis, and heterocycle formation. The methyl ester groups enhance solubility in organic solvents, facilitating purification and downstream modifications. This compound is particularly valued for its role in producing fine chemicals and bioactive molecules, where controlled stereochemistry and functional group compatibility are critical. Its stability under standard storage conditions and compatibility with common reagents make it a practical choice for laboratory and industrial-scale processes.
40149-67-5 structure
Product Name:1,4-dimethyl 2-aminobutanedioate
CAS No:40149-67-5
MF:C6H11NO4
MW:161.155842065811
MDL:MFCD22384344
CID:334882
PubChem ID:419227
Update Time:2025-10-29
1,4-dimethyl 2-aminobutanedioate Chemical and Physical Properties
Names and Identifiers
-
- Asparticacid, 1,4-dimethyl ester
- dimethyl DL-aspartate
- dimethyl 2-aminobutanedioate
- 1,4-dimethyl 2-aminobutanedioate
- EINECS 254-813-2
- Asparaginsauredimethylester
- EN300-34901
- Aspartic acid, dimethyl ester
- AKOS015997603
- 40149-67-5
- SCHEMBL196759
-
- MDL： MFCD22384344
- Inchi： 1S/C6H11NO4/c1-10-5(8)3-4(7)6(9)11-2/h4H,3,7H2,1-2H3
- InChI Key： BYHXBBOSJKPUJL-UHFFFAOYSA-N
- SMILES： O(C)C(C(CC(=O)OC)N)=O
Computed Properties
- Exact Mass: 161.06883
- Monoisotopic Mass: 161.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 157
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.9
- Topological Polar Surface Area: 78.6?2
Experimental Properties
- Density: 1.162
- Boiling Point: 223°Cat760mmHg
- Flash Point: 88.9°C
- PSA: 78.62
1,4-dimethyl 2-aminobutanedioate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-68905-0.05g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 0.05g |
$19.0 | 2023-02-13 | ||
| Enamine | EN300-68905-0.1g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 0.1g |
$19.0 | 2023-02-13 | ||
| Enamine | EN300-68905-0.25g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 0.25g |
$19.0 | 2023-02-13 | ||
| Enamine | EN300-68905-0.5g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 0.5g |
$21.0 | 2023-02-13 | ||
| Enamine | EN300-68905-1.0g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 1.0g |
$26.0 | 2023-02-13 | ||
| Enamine | EN300-68905-2.5g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 2.5g |
$27.0 | 2023-02-13 | ||
| Enamine | EN300-68905-5.0g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 5.0g |
$29.0 | 2023-02-13 | ||
| Enamine | EN300-68905-10.0g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 10.0g |
$32.0 | 2023-02-13 | ||
| Enamine | EN300-34901-0.05g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 95.0% | 0.05g |
$19.0 | 2025-03-18 | |
| Enamine | EN300-34901-0.1g |
1,4-dimethyl 2-aminobutanedioate |
40149-67-5 | 95.0% | 0.1g |
$19.0 | 2025-03-18 |
1,4-dimethyl 2-aminobutanedioate Related Literature
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
40149-67-5 (1,4-dimethyl 2-aminobutanedioate) Related Products
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- 15399-22-1(Methyl (2S)-2-Aminobutanoate)
- 17812-32-7(H-Asp-OMe)
- 2177-62-0(β-Methyl Aspartate)
- 21860-85-5(Aspartic acid, 1-ethylester)
- 65414-77-9(H-DL-Asp-OMe)
- 13552-87-9(L-Aspartic acid,1,4-diethyl ester)
- 65414-78-0(D-Aspartic Acid 1-Methyl Ester)
- 6384-18-5(L-Aspartic acid,1,4-dimethyl ester)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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