1-Pyrrolidino-1-cyclopentene - CAS 7148-07-4

Catalog:	BB034391
Product Name:	1-Pyrrolidino-1-cyclopentene
CAS:	7148-07-4
Synonyms:	1-(cyclopenten-1-yl)pyrrolidine

Technical Data

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Computed Properties

IUPAC Name:	1-(cyclopenten-1-yl)pyrrolidine
Description:	1-pyrrolidino-1-cyclopentene was used in the synthesis of halichlorine, pinnaic acid, and tauropinnaic acid.
Molecular Weight:	137.22
Molecular Formula:	C9H15N
Canonical SMILES:	C1CCN(C1)C2=CCCC2
InChI:	InChI=1S/C9H15N/c1-2-6-9(5-1)10-7-3-4-8-10/h5H,1-4,6-8H2
InChI Key:	KOFSFYBXUYHNJL-UHFFFAOYSA-N
Boiling Point:	100-110 °C (15 mmHg)
Purity:	95 %
Density:	0.941 g/cm³
Appearance:	Clear brown clear liquid
Storage:	0-6 °C
MDL:	MFCD00003162
LogP:	2.08790

Publication Number	Title	Priority Date
CN-111253246-A	Acyl acid derivative and preparation method and medical application thereof	20200316
WO-2021164746-A1	Substituted aryl compound	20200219
WO-2020249759-A1	Method for fluoroalkylation of enamines	20190612
EP-3747860-A1	Novel cyclohexanone based plasticisers	20190604
US-2020299130-A1	Heterogeneous hydrogen-catalyst reactor	20190319

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GHS Hazard Statement:	H226 (91.11%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Warning

Complexity:	143
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.120449483
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	137.120449483
Rotatable Bond Count:	1
Topological Polar Surface Area:	3.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1