1-Piperidinecarbonyl chloride - CAS 13939-69-0

Catalog:	BB008935
Product Name:	1-Piperidinecarbonyl chloride
CAS:	13939-69-0
Synonyms:	piperidine-1-carbonyl chloride

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	piperidine-1-carbonyl chloride
Description:	1-Piperidinecarbonyl chloride (CAS# 13939-69-0) is a useful research chemical.
Molecular Weight:	147.60
Molecular Formula:	C6H10ClNO
Canonical SMILES:	C1CCN(CC1)C(=O)Cl
InChI:	InChI=1S/C6H10ClNO/c7-6(9)8-4-2-1-3-5-8/h1-5H2
InChI Key:	BIFDXOOJPDHKJH-UHFFFAOYSA-N
Boiling Point:	238.6 °C at 760 mmHg
Density:	1.18 g/mL at 25 °C (lit.)
Appearance:	Colorless liquid
MDL:	MFCD00973554
LogP:	1.76900

Publication Number	Title	Priority Date
CN-113354677-A	Acrylonitrile compound and preparation method and application thereof	20210120
WO-2021202964-A1	Allosteric chromenone inhibitors of phosphoinositide 3-kinase (pi3k) for the treatment of diseases associated with p13k modulation	20200403
WO-2021187878-A1	Compound for inhibiting mutagenic trk fusion protein, and pharmaceutical use and manufacturing method thereof	20200317
WO-2021164661-A1	2-phenylcyclopropylmethylamine derivative, and preparation method and use thereof	20200220
CN-111116514-A	Preparation method of 1-cyclopropane formyl piperazine hydrochloride	20200110

PMID	Publication Date	Title	Journal
22312278	20120101	Use of Linear Free Energy Relationships (LFERs) to elucidate the mechanisms of reaction of a γ-methyl-β-alkynyl and an ortho-substituted aryl chloroformate ester	International journal of molecular sciences
18321703	20080315	New nordihydroguaiaretic acid derivatives as anti-HIV agents	Bioorganic & medicinal chemistry letters

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[1427004-19-0]
DBCO-PEG4-NHS ester
[17746-05-3]
Undecanoyl chloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

Piperidines

[821768-09-6]
1-(3-(Trifluoromethyl)pyridin-2-yl)piperidine-4-carboxylic acid
[313685-03-9]
Ethyl 1-[(4-chlorophenyl)sulfonyl]piperidine-4-carboxylate
[681428-42-2]
Ethyl 1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperidine-4-carboxylate
[1189664-19-4]
Ethyl 1-(3-chlorobenzyl)piperidine-3-carboxylate hydrochloride
[931998-13-9]
Ethyl 1-(4-methyl-6-(trifluoromethyl)pyrimidin-2-yl)piperidine-3-carboxylate
[349625-89-4]
Ethyl 1-(methylsulfonyl)piperidine-3-carboxylate

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	110
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.0450916
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	147.0450916
Rotatable Bond Count:	0
Topological Polar Surface Area:	20.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6