1-Benzoylpiperazine hydrochloride - CAS 56227-55-5
Catalog: |
BB029300 |
Product Name: |
1-Benzoylpiperazine hydrochloride |
CAS: |
56227-55-5 |
Synonyms: |
phenyl(piperazin-1-yl)methanone;hydrochloride |
IUPAC Name: | phenyl(piperazin-1-yl)methanone;hydrochloride |
Description: | 1-Benzoylpiperazine hydrochloride (CAS# 56227-55-5) is a useful research chemical. |
Molecular Weight: | 226.70 |
Molecular Formula: | C11H14N2O · HCl |
Canonical SMILES: | C1CN(CCN1)C(=O)C2=CC=CC=C2.Cl |
InChI: | InChI=1S/C11H14N2O.ClH/c14-11(10-4-2-1-3-5-10)13-8-6-12-7-9-13;/h1-5,12H,6-9H2;1H |
InChI Key: | KSVFXAZDBKITEF-UHFFFAOYSA-N |
Boiling Point: | 370.9 °C at 760 mmHg |
MDL: | MFCD00459578 |
LogP: | 1.80070 |
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, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
RU-2633699-C2 | Pyrimidyl-di(diazadispiroalkane)s with antiviral activity | 20151020 |
WO-2017069661-A1 | Pyrimidyl-di(diazaspiro-alkanes) with antiviral activity | 20151020 |
EP-3325462-A1 | Lysyl oxidase-like 2 inhibitors and uses thereof | 20150723 |
JP-2018521044-A | Lysyl oxidase like 2 inhibitor and its use | 20150723 |
US-2018215727-A1 | Lysyl oxidase-like 2 inhibitors and uses thereof | 20150723 |
Complexity: | 194 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.0872908 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.0872908 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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