2-(Aminoethyl)-2-methyl-1,3-dioxolane - CAS 62240-37-3
Catalog: |
BB031481 |
Product Name: |
2-(Aminoethyl)-2-methyl-1,3-dioxolane |
CAS: |
62240-37-3 |
Synonyms: |
2-(2-methyl-1,3-dioxolan-2-yl)ethanamine; 2-(2-methyl-1,3-dioxolan-2-yl)ethanamine |
IUPAC Name: | 2-(2-methyl-1,3-dioxolan-2-yl)ethanamine |
Description: | Used in the total synthesis of (+/-)-Methyl Homodaphniphyllate. |
Molecular Weight: | 131.17 |
Molecular Formula: | C6H13NO2 |
Canonical SMILES: | CC1(OCCO1)CCN |
InChI: | InChI=1S/C6H13NO2/c1-6(2-3-7)8-4-5-9-6/h2-5,7H2,1H3 |
InChI Key: | GVVWCRQQBUQLMZ-UHFFFAOYSA-N |
Boiling Point: | 178.2 °C at 760 mmHg |
Density: | 1.005 g/cm3 |
Appearance: | Liquid |
MDL: | MFCD09923503 |
LogP: | 0.79850 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CA-2967694-A1 | Indole and azaindoles derivatives and their use in neurodegenerative diseases | 20141215 |
EP-3233841-A1 | Indole and azaindoles derivatives and their use in neurodegenerative diseases | 20141215 |
JP-2017537982-A | Indole and azaindole derivatives and their use in neurodegenerative diseases | 20141215 |
US-10323000-B2 | Indole derivatives and their use in neurodegenerative diseases | 20141215 |
US-10676433-B2 | Indole derivatives and their use in neurodegenerative diseases | 20141215 |
Complexity: | 89.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 131.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 131.094628657 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 44.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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Amines and Anilines
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