(3-Aminobenzyl)diethylamine - CAS 27958-97-0
Catalog: |
BB019720 |
Product Name: |
(3-Aminobenzyl)diethylamine |
CAS: |
27958-97-0 |
Synonyms: |
3-(diethylaminomethyl)aniline |
IUPAC Name: | 3-(diethylaminomethyl)aniline |
Description: | (3-Aminobenzyl)diethylamine (CAS# 27958-97-0) is a useful research chemical. |
Molecular Weight: | 178.27 |
Molecular Formula: | C11H18N2 |
Canonical SMILES: | CCN(CC)CC1=CC(=CC=C1)N |
InChI: | InChI=1S/C11H18N2/c1-3-13(4-2)9-10-6-5-7-11(12)8-10/h5-8H,3-4,9,12H2,1-2H3 |
InChI Key: | VGVXOXSRINSIFO-UHFFFAOYSA-N |
Boiling Point: | 272 ℃ at 760 mmHg |
Density: | 0.983 g/cm3 |
MDL: | MFCD06804491 |
LogP: | 2.69180 |
Publication Number | Title | Priority Date |
EP-3056202-A1 | Benzopyrrolidone derivatives possessing antiviral and anticancer properties | 20150216 |
WO-2016131789-A1 | Benzopyrrolidone derivatives possessing antiviral and anticancer properties | 20150216 |
EP-3473099-A1 | Indazole-3-carboxamides and their use as wnt/b-catenin signaling pathway inhibitors | 20110914 |
AU-2010292116-A1 | Pharmaceutically useful heterocycle-substituted lactams | 20090911 |
CA-2773854-A1 | Pharmaceutically useful heterocycle-substituted lactams | 20090911 |
Complexity: | 132 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.146998583 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.146998583 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 29.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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