2-(p-Tolyl)pyrrolidine - CAS 62506-76-7

Catalog:	BB031624
Product Name:	2-(p-Tolyl)pyrrolidine
CAS:	62506-76-7
Synonyms:	2-(4-methylphenyl)pyrrolidine; 2-(4-methylphenyl)pyrrolidine

Technical Data

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Computed Properties

IUPAC Name:	2-(4-methylphenyl)pyrrolidine
Description:	2-(p-Tolyl)pyrrolidine (CAS# 62506-76-7) is a useful research chemical.
Molecular Weight:	161.24
Molecular Formula:	C11H15N
Canonical SMILES:	CC1=CC=C(C=C1)C2CCCN2
InChI:	InChI=1S/C11H15N/c1-9-4-6-10(7-5-9)11-3-2-8-12-11/h4-7,11-12H,2-3,8H2,1H3
InChI Key:	TXFISDWSKUHPET-UHFFFAOYSA-N
Boiling Point:	259.6 °C at 760 mmHg
Density:	0.975 g/cm³
MDL:	MFCD02663452
LogP:	2.74830

Publication Number	Title	Priority Date
CN-110922098-A	Regenerated asphalt mixture and preparation method thereof	20191121
CN-110922098-B	Regenerated asphalt mixture and preparation method thereof	20191121
CN-110483361-B	beta-C (sp)3) Synthesis of (E) -H functionalized and aromatized pyrroles	20190904
WO-2020233618-A1	Inhibitors for programmed cell necrosis and preparation method therefor and use thereof	20190521
WO-2020185830-A1	Charged ion channel blockers and methods for use	20190311

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.120449483
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	161.120449483
Rotatable Bond Count:	1
Topological Polar Surface Area:	12 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2