N-Boc-tyramine - CAS 64318-28-1
Catalog: |
BB032434 |
Product Name: |
N-Boc-tyramine |
CAS: |
64318-28-1 |
Synonyms: |
tert-butyl N-[2-(4-hydroxyphenyl)ethyl]carbamate |
IUPAC Name: | tert-butyl N-[2-(4-hydroxyphenyl)ethyl]carbamate |
Description: | Intermediate in the preparation of Thyroxin derivatives. |
Molecular Weight: | 237.29 |
Molecular Formula: | C13H19NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)NCCC1=CC=C(C=C1)O |
InChI: | InChI=1S/C13H19NO3/c1-13(2,3)17-12(16)14-9-8-10-4-6-11(15)7-5-10/h4-7,15H,8-9H2,1-3H3,(H,14,16) |
InChI Key: | ILNOTKMMDBWGOK-UHFFFAOYSA-N |
Boiling Point: | 395.7 °C at 760 mmHg |
Density: | 1.1 g/cm3 |
MDL: | MFCD05864730 |
LogP: | 2.85030 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111995622-A | Compound and use thereof | 20200820 |
WO-2021171984-A1 | Organic el display device, production method for cured product, and production method for organic el display device | 20200225 |
WO-2021060395-A1 | Sustained-release pharmaceutical composition | 20190925 |
WO-2020008013-A1 | Amino-pyrimidonyl derivatives, a process for their preparation and pharmaceutical compositions containing them | 20180705 |
EP-3818054-A1 | Amino-pyrimidonyl derivatives, a process for their preparation and pharmaceutical compositions containing them | 20180705 |
PMID | Publication Date | Title | Journal |
15560474 | 20041105 | Construction and application of a stoichiometric displacement model for retention in chiral recognition of molecular imprinting | Journal of chromatography. A |
Complexity: | 240 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 237.13649347 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 237.13649347 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 58.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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