1-[2-(Dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid - CAS 856437-22-4
Catalog: |
BB037671 |
Product Name: |
1-[2-(Dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid |
CAS: |
856437-22-4 |
Synonyms: |
1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid |
IUPAC Name: | 1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid |
Description: | 1-[2-(Dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid (CAS# 856437-22-4) is a useful research chemical. |
Molecular Weight: | 200.23 |
Molecular Formula: | C9H16N2O3 |
Canonical SMILES: | CN(C)CCN1CC(CC1=O)C(=O)O |
InChI: | InChI=1S/C9H16N2O3/c1-10(2)3-4-11-6-7(9(13)14)5-8(11)12/h7H,3-6H2,1-2H3,(H,13,14) |
InChI Key: | YLZBIUIUXVYRRQ-UHFFFAOYSA-N |
Boiling Point: | 384.8 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.203 g/cm3 |
MDL: | MFCD06589779 |
LogP: | -0.58100 |
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, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2013167307-A1 | Composition comprising at least one 2-pyrrolidone functionalized in the 4 position with a carboxylic acid or amide, and at least one direct dye or a pigment for dyeing keratin fibres | 20100609 |
US-8585779-B2 | Composition comprising at least one 2-pyrrolidone functionalized in the 4 position with a carboxylic acid or amide, and at least one direct dye or a pigment for dyeing keratin fibres | 20100609 |
WO-2011154460-A1 | Composition comprising at least one 2-pyrrolidone functionalized in the 4 position with a carboxylic acid or amide, and at least one direct dye or a pigment for dyeing keratin fibres | 20100609 |
AU-2005243188-A1 | Beta-carbolines useful for treating inflammatory disease | 20040409 |
CA-2561859-A1 | Beta-carbolines useful for treating inflammatory disease | 20040409 |
Complexity: | 240 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.11609238 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.11609238 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 60.8 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -3.3 |
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Related Functional Groups
Pyrrolidines
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