- Palladium-catalyzed alkoxycarbonylation of unactivated secondary alkyl bromides at low pressureSargent, Brendon T.; Alexanian, Erik J., Journal of the American Chemical Society, 2016, 138(24), 7520-7523
Cas no 939793-16-5 (Tert-butyl 3-bromopyrrolidine-1-carboxylate)
939793-16-5 structure
Product Name:Tert-butyl 3-bromopyrrolidine-1-carboxylate
CAS No:939793-16-5
MF:C9H16BrNO2
MW:250.132842063904
MDL:MFCD08752478
CID:822067
PubChem ID:329763890
Update Time:2024-10-26
Tert-butyl 3-bromopyrrolidine-1-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- tert-Butyl 3-bromopyrrolidine-1-carboxylate
- (±)-1-Boc-3-bromopyrrolidine
- 1-Boc-3-bromopyrrolidine
- N-BOC-3-BROMOPYRROLIDINE
- 3-BROMO-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
- C9H16BrNO2
- (R)-1-Boc-3-bromopyrrolidine
- QJTKPXFJOXKUEY-UHFFFAOYSA-N
- HT893
- CT0157
- MB06656
- SY029314
- (+/-)-1-BOC-3-BROMOPY
- 1,1-Dimethylethyl 3-bromo-1-pyrrolidinecarboxylate (ACI)
- 3-Bromopyrrolidine-1-carboxylic acid tert-butyl ester
- Tert-butyl 3-bromopyrrolidine-1-carboxylate
-
- MDL： MFCD08752478
- Inchi： 1S/C9H16BrNO2/c1-9(2,3)13-8(12)11-5-4-7(10)6-11/h7H,4-6H2,1-3H3
- InChI Key： QJTKPXFJOXKUEY-UHFFFAOYSA-N
- SMILES： O=C(N1CC(Br)CC1)OC(C)(C)C
Computed Properties
- Exact Mass: 249.03600
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 200
- 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
- Topological Polar Surface Area: 29.5
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.1
Experimental Properties
- Color/Form: White to Yellow Solid
- Melting Point: 47-52?°C
- Boiling Point: 277.5±33.0°C at 760 mmHg
- Flash Point: Degrees Fahrenheit:>230°F
Degrees Celsius:>110°C - Water Partition Coefficient: Slightly soluble in water.
- PSA: 29.54000
- LogP: 2.32860
Tert-butyl 3-bromopyrrolidine-1-carboxylate Security Information
-
Symbol:
- Signal Word：Warning
- Hazard Statement： H302-H319-H400
- Warning Statement： P273-P305+P351+P338
- Hazardous Material transportation number：UN 3077 9 / PGIII
- WGK Germany：3
- Hazard Category Code： 22-36-50
- Safety Instruction： 26-61
-
Hazardous Material Identification：
- HazardClass：9
- Storage Condition：2-8°C
Tert-butyl 3-bromopyrrolidine-1-carboxylate 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%
Tert-butyl 3-bromopyrrolidine-1-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A109006092-10g |
tert-Butyl 3-bromopyrrolidine-1-carboxylate |
939793-16-5 | 98% | 10g |
$272.50 | 2023-08-31 | |
| Alichem | A109006092-25g |
tert-Butyl 3-bromopyrrolidine-1-carboxylate |
939793-16-5 | 98% | 25g |
$495.00 | 2023-08-31 | |
| Alichem | A109006092-100g |
tert-Butyl 3-bromopyrrolidine-1-carboxylate |
939793-16-5 | 98% | 100g |
$1225.00 | 2023-08-31 | |
| Fluorochem | 048496-10g |
N-Boc-3-Bromopyrrolidine |
939793-16-5 | 98% | 10g |
￡245.00 | 2022-03-01 | |
| Fluorochem | 048496-25g |
N-Boc-3-Bromopyrrolidine |
939793-16-5 | 98% | 25g |
￡489.00 | 2022-03-01 | |
| TRC | B201130-100mg |
N-Boc-3-bromopyrrolidine |
939793-16-5 | 100mg |
$ 64.00 | 2023-04-19 | ||
| TRC | B201130-250mg |
N-Boc-3-bromopyrrolidine |
939793-16-5 | 250mg |
$ 87.00 | 2023-04-19 | ||
| TRC | B201130-500mg |
N-Boc-3-bromopyrrolidine |
939793-16-5 | 500mg |
$ 133.00 | 2023-04-19 | ||
| TRC | B201130-1g |
N-Boc-3-bromopyrrolidine |
939793-16-5 | 1g |
$ 178.00 | 2023-04-19 | ||
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | T21180-1g |
tert-Butyl 3-bromopyrrolidine-1-carboxylate |
939793-16-5 | 98% | 1g |
￥75.0 | 2024-07-18 |
Tert-butyl 3-bromopyrrolidine-1-carboxylate Production Method
Production Method 1
Reaction Conditions
1.1 Reagents: Carbon tetrabromide , Triphenylphosphine Solvents: Tetrahydrofuran ; rt; overnight, rt
Reference
Production Method 2
Reaction Conditions
1.1 Reagents: Carbon tetrabromide , Triphenylphosphine Solvents: Tetrahydrofuran ; rt; overnight, rt
Reference
- Preparation of azaheterocyclyl derivatives of androstanes as medicaments for cardiovascular disorders, World Intellectual Property Organization, , ,
Production Method 3
Reaction Conditions
1.1 Reagents: Carbon tetrabromide , Triphenylphosphine Solvents: Dichloromethane ; cooled; overnight, rt
Reference
- Trisubstituted Pyridinylimidazoles as Potent Inhibitors of the Clinically Resistant L858R/T790M/C797S EGFR Mutant: Targeting of Both Hydrophobic Regions and the Phosphate Binding SiteGuenther, Marcel; Lategahn, Jonas; Juchum, Michael; Doering, Eva; Keul, Marina; et al, Journal of Medicinal Chemistry, 2017, 60(13), 5613-5637
Production Method 4
Reaction Conditions
1.1 Reagents: Carbon tetrabromide Catalysts: Triphenylphosphine Solvents: Tetrahydrofuran ; rt; 4 h, rt
Reference
- Indole derivatives and pharmaceutical application, World Intellectual Property Organization, , ,
Production Method 5
Reaction Conditions
1.1 Reagents: Carbon tetrabromide , Triphenylphosphine Solvents: Tetrahydrofuran ; 0 °C → rt; 20 h, rt
Reference
- Preparation of biaryl carboxamides as platelet-activating factor receptors antagonists, World Intellectual Property Organization, , ,
Production Method 6
Reaction Conditions
1.1 Reagents: Carbon tetrabromide , Triphenylphosphine Solvents: Tetrahydrofuran ; 0 °C; 0 °C → rt; 20 h, rt
Reference
- Benzimidazole and azabenzimidazole carboxamides as platelet-activating factor receptor antagonists and their preparation, pharmaceutical compositions and use in the treatment of diseases, World Intellectual Property Organization, , ,
Tert-butyl 3-bromopyrrolidine-1-carboxylate Raw materials
Tert-butyl 3-bromopyrrolidine-1-carboxylate Preparation Products
Tert-butyl 3-bromopyrrolidine-1-carboxylate Related Literature
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
939793-16-5 (Tert-butyl 3-bromopyrrolidine-1-carboxylate) Related Products
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