CAS Number68076-36-8
Synonyms2-Methyl-2-propanyl (4-aminobutyl)carbamate; BOC-NH(CH2)4NH2 HCL; tert-butyl 4-aminobutylcarbamate; Carbamic acid, N-(4-aminobutyl)-, 1,1-dimethylethyl ester; (4-amino-butyl)-carbamic acid tert-butyl ester; N-(1,1-dimethylethoxycarbonyl)-1,4-butanediamine; BOC-DIAMINOBUTANE HCL; N-Boc-1,4-butanediamine; N-Boc-1,4-butandiamine; N-T-BOC-BUTANDIAMINE HCL; (4-aminobutyl)carbamic acid 1,1-dimethylethyl ester; BUTTPARK 121 6-09; RARECHEM AR PA 0023; tert-ButylN-(4-aminobutyl)carbamate; 4-(t-butoxycarbonylamino)butylamine; N-BOC-1,4-DIAMINOBUTANE; AURORA KA-4397; N-(tert-butoxycarbonyl)-1,4-diamino-butane; BOC-DAB HCL; N-tert-Butoxycarbonyl-1,4-butanediamine; MFCD02090802; tert-butyl 4-amino butylcarbamate
Molecular Formula(CH3)3COCONH(CH2)4NH2
Molecular Weight188.27
Purity≥97.0 (GC/NT)%
Density1.0±0.1 g/cm3
Boiling Point292.9±23.0 °C at 760 mmHg
AppearanceLiquid;Colorless to Almost colorless clear liquid
Symbol
Signal WordWarning
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| Chemical & Physical Properties | |
|---|---|
| CAS Number | 68076-36-8 |
| Catalog No. | 2A-9046699 |
| Chinese Name | N-(叔丁氧羰基)-1,4-丁二胺 |
| Synonyms | 2-Methyl-2-propanyl (4-aminobutyl)carbamate; BOC-NH(CH2)4NH2 HCL; tert-butyl 4-aminobutylcarbamate; Carbamic acid, N-(4-aminobutyl)-, 1,1-dimethylethyl ester; (4-amino-butyl)-carbamic acid tert-butyl ester; N-(1,1-dimethylethoxycarbonyl)-1,4-butanediamine; BOC-DIAMINOBUTANE HCL; N-Boc-1,4-butanediamine; N-Boc-1,4-butandiamine; N-T-BOC-BUTANDIAMINE HCL; (4-aminobutyl)carbamic acid 1,1-dimethylethyl ester; BUTTPARK 121 6-09; RARECHEM AR PA 0023; tert-ButylN-(4-aminobutyl)carbamate; 4-(t-butoxycarbonylamino)butylamine; N-BOC-1,4-DIAMINOBUTANE; AURORA KA-4397; N-(tert-butoxycarbonyl)-1,4-diamino-butane; BOC-DAB HCL; N-tert-Butoxycarbonyl-1,4-butanediamine; MFCD02090802; tert-butyl 4-amino butylcarbamate |
| Molecular Formula | (CH3)3COCONH(CH2)4NH2 |
| Molecular Weight | 188.27 |
| Purity | ≥97.0 (GC/NT) |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 292.9±23.0 °C at 760 mmHg |
| Appearance | Liquid;Colorless to Almost colorless clear liquid |
| Storage Condition | Store in an airtight container in a cool, dry plac |
| Application | NH2-C4-NH-Boc (compound 15) is a PROTAC bridge, belonging to the Alkyl/ether class. NH2-C4-NH-Boc can be used to synthesize a range of PROTAC molecules. PROTAC molecules contain two different ligands |
| HTC | 2924199090 |
| PubChem ID | 57647412 |
| MDL Number | MFCD00210019 |
| SMILES | NCCCCNC(OC(C)(C)C)=O |
| InChI | 1S/C9H20N2O2/c1-9(2,3)13-8(12)11-7-5-4-6-10/h4-7,10H2,1-3H3,(H,11,12) |
| InChI Key | ZFQWJXFJJZUVPI-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1937878 |
| NACRES Code | NA.22 |
| UNSPSC | 12352116 |
| Hazard Symbols | 8.0 |
| MSDS | msds/46699_1_68076_36_8.pdf |
| Bioactivity | NH2-C4-NH-Boc (compound 15) is a PROTAC linker, which refers to the Alkyl/ether composition. NH2-C4-NH-Boc can be used in the synthesis of a series of PROTACs. PROTACs contain two different ligands connected by a linker; one is a ligand for an E3 ubiquitin ligase and the other is for the target protein. PROTACs exploit the intracellular ubiquitin-proteasome system to selectively degrade target proteins[1]. Related Catalog Research Areas >> Cancer Signaling Pathways >> PROTAC >> PROTAC Linker Target Alkyl/ether References [1]. Jiang F, et al.Discovery of novel small molecule induced selective degradation of the bromodomain and extra-terminal (BET) bromodomain protein BRD4 and BRD2 with cellular potencies.Bioorg Med Chem. 2020 Jan 1;28(1):115181. Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 292.9±23.0 °C at 760 mmHg Molecular Formula C9H20N2O2 Molecular Weight 188.267 Flash Point 130.9±22.6 °C Exact Mass 188.152481 PSA 64.35000 LogP 1.06 Vapour Pressure 0.0±0.6 mmHg at 25°C Index of Refraction 1.457 InChIKey ZFQWJXFJJZUVPI-UHFFFAOYSA-N SMILES CC(C)(C)OC(=O)NCCCCN |
| Use of | NH2-C4-NH-Boc (compound 15) is a PROTAC linker, which refers to the Alkyl/ether composition. NH2-C4-NH-Boc can be used in the synthesis of a series of PROTACs. PROTACs contain two different ligands connected by a linker; one is a ligand for an E3 ubiquitin ligase and the other is for the target protein. PROTACs exploit the intracellular ubiquitin-proteasome system to selectively degrade target proteins[1]. Properties Name tert-Butyl N-(4-aminobutyl)carbamate Synonym More Synonyms NH2-C4-NH-Boc Biological Activity Description NH2-C4-NH-Boc (compound 15) is a PROTAC linker, which refers to the Alkyl/ether composition. NH2-C4-NH-Boc can be used in the synthesis of a series of PROTACs. PROTACs contain two different ligands connected by a linker; one is a ligand for an E3 ubiquitin ligase and the other is for the target protein. PROTACs exploit the intracellular ubiquitin-proteasome system to selectively degrade target proteins[1]. Related Catalog Research Areas >> Cancer Signaling Pathways >> PROTAC >> PROTAC Linker Alkyl/ether References [1]. Jiang F, et al.Discovery of novel small molecule induced selective degradation of the bromodomain and extra-terminal (BET) bromodomain protein BRD4 and BRD2 with cellular potencies.Bioorg Med Chem. 2020 Jan 1;28(1):115181. Chemical & Physical Properties Molecular Formula C9H20N2O2 Exact Mass 188.152481 PSA 64.35000 Index of Refraction 1.457 InChIKey ZFQWJXFJJZUVPI-UHFFFAOYSA-N SMILES CC(C)(C)OC(=O)NCCCCN |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 2735 International Dangerous Regulations for sea transport: 2735 International Dangerous Regulations for air transport: 2735 14.2 United Nations shipping name European Land Transport Dangerous Regulations: POLYAMINES, LIQUID, CORROSIVE, N.O.S. (N-Boc-1,4-diaminobutane) IMDG Code: POLYAMINES, LIQUID, CORROSIVE, N.O.S. (N-Boc-1,4-diaminobutane) IFRS: Polyamines, liquid, corrosive, n.o.s. (N-Boc-1,4-diaminobutane) 14.3 Transport hazard categories European Dangerous Regulations for land transport: 8 International Dangerous Regulations for sea transport: 8 International Dangerous Regulations for air transport: 8 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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