4-Piperidineethanol - CAS 622-26-4

Catalog:	BB031466
Product Name:	4-Piperidineethanol
CAS:	622-26-4
Synonyms:	2-piperidin-4-ylethanol

Technical Data

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Computed Properties

IUPAC Name:	2-piperidin-4-ylethanol
Description:	4-Piperidineethanol have been used as an intermediate in the synthetic preparation of cellular-active allosteric inhibitors of FAK.
Molecular Weight:	129.20
Molecular Formula:	C7H15NO
Canonical SMILES:	C1CNCCC1CCO
InChI:	InChI=1S/C7H15NO/c9-6-3-7-1-4-8-5-2-7/h7-9H,1-6H2
InChI Key:	LDSQQXKSEFZAPE-UHFFFAOYSA-N
Boiling Point:	131-136 °C (17 mmHg)
Density:	1.0059 g/cm³ (15 C)
Appearance:	White solid
MDL:	MFCD00006008
LogP:	0.69720

Publication Number	Title	Priority Date
CN-111778001-A	Low-molecular-weight branched shale inhibitor and water-based drilling fluid thereof	20200819
WO-2021203016-A2	Protein-protein interaction stabilizers	20200403
WO-2021194326-A1	Aminopyrimidine derivatives and their use as aryl hydrocarbon receptor modulators	20200327
WO-2021195529-A2	Novel lipids and nanoparticle compositions thereof	20200327
WO-2021172404-A1	Primer composition for optical article, and laminate	20200227

PMID	Publication Date	Title	Journal
21093111	20110101	Synthesis and antifungal activity of some substituted phenothiazines and related compounds	European journal of medicinal chemistry

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Related Functional Groups

Piperidines

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[869951-27-9]
Ethyl 1-(ethylsulfonyl)piperidine-3-carboxylate
[832118-87-3]
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[349625-89-4]
Ethyl 1-(methylsulfonyl)piperidine-3-carboxylate
[832740-03-1]
Ethyl 1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxylate

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GHS Hazard Statement:	H315 (90.16%): 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

Complexity:	69.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	129.115364102
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	129.115364102
Rotatable Bond Count:	2
Topological Polar Surface Area:	32.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2