1-Boc-4-(3-aminopropyl)piperidine - CAS 150349-65-8
Catalog: |
BB010523 |
Product Name: |
1-Boc-4-(3-aminopropyl)piperidine |
CAS: |
150349-65-8 |
Synonyms: |
4-(3-aminopropyl)-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 4-(3-aminopropyl)piperidine-1-carboxylate |
IUPAC Name: | tert-butyl 4-(3-aminopropyl)piperidine-1-carboxylate |
Description: | 1-Boc-4-(3-aminopropyl)piperidine (CAS# 150349-65-8) is a useful research chemical. |
Molecular Weight: | 242.36 |
Molecular Formula: | C13H26N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(CC1)CCCN |
InChI: | InChI=1S/C13H26N2O2/c1-13(2,3)17-12(16)15-9-6-11(7-10-15)5-4-8-14/h11H,4-10,14H2,1-3H3 |
InChI Key: | QZYIDMYWRACBRQ-UHFFFAOYSA-N |
Boiling Point: | 332.1 °C at 760 mmHg |
Density: | 0.999 g/cm3 |
LogP: | 3.01060 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021127190-A1 | Irak degraders and uses thereof | 20191217 |
TW-201943715-A | Bicyclic compound and use thereof for inhibiting histone methyltransferase | 20180413 |
EP-3654968-A1 | Metallo-beta-lactamase inhibitors and methods of use thereof | 20170717 |
WO-2019018186-A1 | METALLO-BETA-LACTAMASE INHIBITORS AND METHODS OF USE | 20170717 |
US-2020281913-A1 | Metallo-Beta-Lactamase Inhibitors and Methods of Use Thereof | 20170717 |
Complexity: | 240 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.199428076 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.199428076 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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Amines and Anilines
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