3,4-Dibenzyloxyphenethylamine hydrochloride - CAS 1699-56-5
Catalog: |
BB012590 |
Product Name: |
3,4-Dibenzyloxyphenethylamine hydrochloride |
CAS: |
1699-56-5 |
Synonyms: |
2-[3,4-bis(phenylmethoxy)phenyl]ethanamine;hydrochloride |
IUPAC Name: | 2-[3,4-bis(phenylmethoxy)phenyl]ethanamine;hydrochloride |
Description: | 3,4-Dibenzyloxyphenethylamine hydrochloride (CAS# 1699-56-5) is a useful research chemical compound. |
Molecular Weight: | 369.88 |
Molecular Formula: | C22H24ClNO2 |
Canonical SMILES: | C1=CC=C(C=C1)COC2=C(C=C(C=C2)CCN)OCC3=CC=CC=C3.Cl |
InChI: | InChI=1S/C22H23NO2.ClH/c23-14-13-18-11-12-21(24-16-19-7-3-1-4-8-19)22(15-18)25-17-20-9-5-2-6-10-20;/h1-12,15H,13-14,16-17,23H2;1H |
InChI Key: | KXIZXPRLNNDQKS-UHFFFAOYSA-N |
Boiling Point: | 493.4 °C at 760 mmHg |
Melting Point: | 131-133 °C (lit.) |
Purity: | 98 % |
Density: | 1.128 g/cm3 |
Appearance: | Beige powder |
MDL: | MFCD00012629 |
LogP: | 5.84810 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P391, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112358446-A | Synthetic method of stable isotope labeled tritoquinol hydrochloride | 20201130 |
US-2020131431-A1 | Chemical additives and surfactant combinations for favorable wettability alteration and improved hydrocarbon recovery factors | 20181026 |
WO-2020086309-A1 | Chemical additives and surfactant combinations for favorable wettability alteration and improved hydrocarbon recovery factors | 20181026 |
CA-2418084-C | Substituted and unsubstituted benzooxathiazoles and compounds derived therefrom | 20000809 |
DE-10038709-A1 | Substituted and unsubstituted benzooxathiazoles and compounds derived from them | 20000809 |
PMID | Publication Date | Title | Journal |
21543232 | 20111201 | Biological evaluation of dopamine analogues containing phenylboronic acid group as new boron carriers | Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine |
15638998 | 20050101 | Apoptosis inducing activity of viscin, a lipophilic extract from Viscum album L | The Journal of pharmacy and pharmacology |
Complexity: | 350 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 369.1495567 |
Formal Charge: | 0 |
Heavy Atom Count: | 26 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 369.1495567 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 44.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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