Benzathine Benzylpenicillin EP Impurity A - CAS 4152-09-4
Catalog: |
BB024902 |
Product Name: |
Benzathine Benzylpenicillin EP Impurity A |
CAS: |
4152-09-4 |
Synonyms: |
N1-(Phenylmethyl)-1,2-ethanediamine; 1-Amino-2-(N-benzylamino)ethane; 2-(Benzylamino)ethylamine; N-(Phenylmethyl)-1,2-ethanediamine; N-Benzyl-1,2-diaminoethane; N-Benzyl-1,2-ethanediamine; N-Benzylethanediamine; NSC 18480 |
Application: |
N-Benzylethylenediamine can be used to develop imidazoline derivatives as ligands for dopamine D4 receptor. It is also a reagent for enantioselective synthesis of epoxides and piperazinones. |
IUPAC Name: | N'-benzylethane-1,2-diamine |
Description: | Benzathine Benzylpenicillin EP Impurity A is an impurity of Benzylpenicillin, which is an antibiotic used to treat a number of bacterial infections. |
Molecular Weight: | 150.22 |
Molecular Formula: | C9H14N2 |
Canonical SMILES: | C1=CC=C(C=C1)CNCCN |
InChI: | InChI=1S/C9H14N2/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5,11H,6-8,10H2 |
InChI Key: | ACYBVNYNIZTUIL-UHFFFAOYSA-N |
Boiling Point: | 259.5±15.0°C at 760 mmHg |
Purity: | ≥95% |
Density: | 1 g/mL at 25°C |
Solubility: | Almost insoluble in water |
Appearance: | Colorless liquid |
Storage: | Store at RT |
MDL: | MFCD00041896 |
LogP: | 1.82610 |
GHS Hazard Statement: | H302 (56.41%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P261, P264, P270, P272, P273, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P333+P313, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021110472-A1 | Process for preparing amines over a copper catalyst | 20191203 |
US-2021161889-A1 | Muscarinic acetylcholine m1 receptor antagonists | 20191202 |
WO-2021083744-A1 | Impregnation resin for a woven or stitched fabric | 20191028 |
WO-2021076448-A1 | Somatostatin modulators for treating pituitary adenomas | 20191014 |
WO-2021058574-A1 | Hardener for epoxy casting resins | 20190925 |
PMID | Publication Date | Title | Journal |
20102368 | 20100401 | Synthesis, characterization, and cytotoxic activity of novel platinum (II) complexes derived from n-benzyl-ethylenediamine and oxalate | Chemical biology & drug design |
Complexity: | 87.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 150.115698455 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.115698455 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 38 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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