Cas no 1049978-93-9 ((3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride)
(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride is a chiral pyrrolidine derivative with a stereochemically defined structure, making it valuable for asymmetric synthesis and pharmaceutical applications. The compound features a 4-methoxyphenyl substituent and a carboxylic acid functional group, enhancing its utility as a building block for bioactive molecules. Its hydrochloride salt form improves solubility and stability, facilitating handling in synthetic workflows. The (3S,4R) configuration ensures high enantiopurity, critical for research in medicinal chemistry and drug development. This compound is particularly useful in the design of enzyme inhibitors, receptor modulators, and other pharmacologically active agents, offering precise stereochemical control for tailored molecular interactions.
1049978-93-9 structure
Product Name:(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride
CAS No:1049978-93-9
MF:C12H16ClNO3
MW:257.713342666626
MDL:MFCD18711702
CID:69759
PubChem ID:2762174
Update Time:2025-05-28
(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- trans-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic acid hydrochloride
- (3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic acid
- (3S,4R)-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid hydrochloride
- Trans-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid HCl
- trans-4-(4-Methoxyphenyl)
- (3R,4S)-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid
- 3-Pyrrolidinecarboxylic acid, 4-(4-Methoxyphenyl)-, (3S,4R)-
- (3R,4S)-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid;hydrochloride
- DS-14021
- 3-Pyrrolidinecarboxylic acid, 4-(4-methoxyphenyl)-, hydrochloride (1:1), (3R,4S)-rel-
- AKOS015924279
- Trans-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid-HCl
- AM20020145
- (3R,4S)-4-(4-METHOXYPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID HCL
- CS-0061966
- W17303
- 2098496-84-3
- (3R,4S)-4-(4-METHOXYPHENYL)PYRROLIDINE-3-CARBOXYLICACIDHCL
- (3R,4S)-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid hydrochloride
- 1049978-93-9
- 1392211-27-6
- I11581
- (3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride
-
- MDL： MFCD18711702
- Inchi： 1S/C12H15NO3.ClH/c1-16-9-4-2-8(3-5-9)10-6-13-7-11(10)12(14)15;/h2-5,10-11,13H,6-7H2,1H3,(H,14,15);1H/t10-,11+;/m1./s1
- InChI Key： XNGVHGXCWZSSEN-DHXVBOOMSA-N
- SMILES： Cl.OC([C@H]1CNC[C@@H]1C1C=CC(=CC=1)OC)=O
Computed Properties
- Exact Mass: 221.10500
- Monoisotopic Mass: 257.082
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 249
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 58.6A^2
Experimental Properties
- Density: 1.2±0.1 g/cm3
- Boiling Point: 406.1±45.0 °C at 760 mmHg
- Flash Point: 199.4±28.7 °C
- PSA: 58.56000
- LogP: 1.41160
- Vapor Pressure: 0.0±1.0 mmHg at 25°C
(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride 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%
(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride Pricemore >>
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| TRC | M350478-100mg |
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| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-LS634-100mg |
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1615CNY | 2021-05-08 |
(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride Suppliers
Amadis Chemical Company Limited
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(CAS:1049978-93-9)(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride
Order Number:A1961
Stock Status:in Stock
Quantity:100mg
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:01
Price ($):197.0
Email:[email protected]
(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride Related Literature
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Xiongfei Zheng,Xuefeng Huang,Yuanzhou Song,Yanhui Guo RSC Adv., 2015,5, 105618-105621
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Recommended suppliers
Amadis Chemical Company Limited
(CAS:1049978-93-9)(3S,4R)-4-(4-Methoxyphenyl)pyrrolidine-3-carboxylic Acid Hydrochloride
Purity:99%
Quantity:100mg
Price ($):197.0