2-(thiophen-2-yl)pyrrolidine - CAS 90090-64-5

Catalog:	BB053499
Product Name:	2-(thiophen-2-yl)pyrrolidine
CAS:	90090-64-5
Synonyms:	2-(2-thienyl)pyrrolidine; 2-(thien-2-yl)pyrrolidine; 2-thien-2-ylpyrrolidine

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	2-thiophen-2-ylpyrrolidine
Molecular Weight:	153.25
Molecular Formula:	C8H11NS
Canonical SMILES:	C1CC(NC1)C2=CC=CS2
InChI:	InChI=1S/C8H11NS/c1-3-7(9-5-1)8-4-2-6-10-8/h2,4,6-7,9H,1,3,5H2
InChI Key:	BNUVOMNEUJWHCF-UHFFFAOYSA-N
Boiling Point:	245.0±28.0 °C at 760 mmHg
Purity:	97%
Density:	1.1±0.1 g/cm3
Appearance:	Pale Yellow to Light Brown Solid

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Related Functional Groups

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[1353995-46-6]
(R)-1-((2,4-Dichlorophenyl)sulfonyl)pyrrolidin-3-ol

Thiophenes

[13196-28-6]
2-Phenyl-1-(thiophen-2-yl)ethanone
[851176-37-9]
2-Morpholino-2-(2-thienyl)ethylamine
[13669-10-8]
Ethyl (2-thenoyl)acetate
[350989-99-0]
Ethyl 2-amino-4-(4-ethylphenyl)thiophene-3-carboxylate
[315683-17-1]
Ethyl 2-amino-4-(4-isopropylphenyl)thiophene-3-carboxylate
[329082-05-5]
Ethyl 2-amino-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	116
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.06122053
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	153.06122053
Rotatable Bond Count:	1
Topological Polar Surface Area:	40.3
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5