4-Piperidinopiperidine-1-carbonyl chloride - CAS 103816-19-9

Catalog:	BB001226
Product Name:	4-Piperidinopiperidine-1-carbonyl chloride
CAS:	103816-19-9
Synonyms:	4-piperidin-1-ylpiperidine-1-carbonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-piperidin-1-ylpiperidine-1-carbonyl chloride
Description:	4-Piperidinopiperidine-1-carbonyl chloride (CAS# 103816-19-9) is used as a reagent in the synthesis of Irinotecan Hydrochloride Trihydrate (I767500); a DNA topoisomerase inhibitor.
Molecular Weight:	230.73
Molecular Formula:	C11H19ClN2O
Canonical SMILES:	C1CCN(CC1)C2CCN(CC2)C(=O)Cl
InChI:	InChI=1S/C11H19ClN2O/c12-11(15)14-8-4-10(5-9-14)13-6-2-1-3-7-13/h10H,1-9H2
InChI Key:	YDNSNQRKIINKPV-UHFFFAOYSA-N
Purity:	95 %
Storage:	Inert atmosphere, 2-8 ℃
LogP:	2.17130

Publication Number	Title	Priority Date
CN-113121554-A	Synthetic method of irinotecan hydrochloride	20210520
WO-2021172359-A1	Cdk9 inhibitor prodrug and liposome including the same	20200225
WO-2021110076-A1	Oxamide derivatives, preparation method therefor and use thereof in medicine	20191204
WO-2021100029-A2	Prodrugs of fulvestrant	20191124
WO-2020242253-A1	Novel empagliflozin derivative which is sglt-2 inhibitor	20190530

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Related Functional Groups

Piperidines

[13617-02-2]
3-Bromo-1-methylpiperidine Hydrobromide
[874800-64-3]
1-(4-Chloro-2-nitrophenyl)piperidine-4-carboxylic acid
[681428-42-2]
Ethyl 1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperidine-4-carboxylate
[393845-35-7]
Ethyl 1-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperidine-4-carboxylate
[1189664-19-4]
Ethyl 1-(3-chlorobenzyl)piperidine-3-carboxylate hydrochloride
[1006349-05-8]
Ethyl 1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxylate

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	221
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	230.1185909
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	230.1185909
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2