1-Phenylaziridine - CAS 696-18-4

Catalog:	BB033897
Product Name:	1-Phenylaziridine
CAS:	696-18-4
Synonyms:	1-phenylaziridine; 1-phenylaziridine

Technical Data

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Computed Properties

IUPAC Name:	1-phenylaziridine
Description:	1-Phenylaziridine (CAS# 696-18-4) is a useful research chemical compound.
Molecular Weight:	119.16
Molecular Formula:	C8H9N
Canonical SMILES:	C1CN1C2=CC=CC=C2
InChI:	InChI=1S/C8H9N/c1-2-4-8(5-3-1)9-6-7-9/h1-5H,6-7H2
InChI Key:	YKNKBBMRKMLLJS-UHFFFAOYSA-N
Boiling Point:	195.3 °C at 760 mmHg
Density:	1.098 g/cm³
LogP:	1.57160

Publication Number	Title	Priority Date
CN-113512587-A	Marker for cancer cell drug resistance, preparation combination for reversing cancer cell drug resistance and application thereof	20210421
CN-111217737-A	Synthesis method of 1-trifluoroethoxy indan-succinimide compound	20200313
CN-111153847-A	Method for preparing 4- (aryl diazenyl) -2, 3-pyrroline derivative	20200110
WO-2021127404-A1	Tricyclic pyridones and pyrimidones	20191220
US-2021016589-A1	Primer for inkjet and method for manufacturing a printed material	20190719

PMID	Publication Date	Title	Journal
19965930	20100201	Antiinflammatory properties of a plant-derived nonsteroidal, dissociated glucocorticoid receptor modulator in experimental autoimmune encephalomyelitis	Molecular endocrinology (Baltimore, Md.)
19675162	20090901	Compound A, a plant origin ligand of glucocorticoid receptors, increases regulatory T cells and M2 macrophages to attenuate experimental autoimmune neuritis with reduced side effects	Journal of immunology (Baltimore, Md. : 1950)
19086905	20090115	Synthesis of optically active arylaziridines by regio- and stereospecific lithiation of N-bus-phenylaziridine	Organic letters
16243974	20051101	A fully dissociated compound of plant origin for inflammatory gene repression	Proceedings of the National Academy of Sciences of the United States of America
9037251	19970124	Mechanism for the stabilization in vivo of the aziridine precursor --(4-acetoxyphenyl)-2-chloro-N-methyl-ethylammonium chloride by serum proteins	Biochemical pharmacology

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Complexity:	90.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	119.073499291
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	119.073499291
Rotatable Bond Count:	1
Topological Polar Surface Area:	3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5