α-(4-Tolylimino)-p-cresol - CAS 3230-51-1

Catalog:	BB021250
Product Name:	α-(4-Tolylimino)-p-cresol
CAS:	3230-51-1
Synonyms:	4-[(4-methylphenyl)iminomethyl]phenol

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Computed Properties

IUPAC Name:	4-[(4-methylphenyl)iminomethyl]phenol
Description:	α-(4-Tolylimino)-p-cresol (CAS# 3230-51-1) is a useful research chemical.
Molecular Weight:	211.26
Molecular Formula:	C14H13NO
Canonical SMILES:	CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)O
InChI:	InChI=1S/C14H13NO/c1-11-2-6-13(7-3-11)15-10-12-4-8-14(16)9-5-12/h2-10,16H,1H3
InChI Key:	LXUWDLKAQOFUGU-UHFFFAOYSA-N
MDL:	MFCD00029735
LogP:	3.05890

Publication Number	Title	Priority Date
US-2016355473-A1	Beta-lactam cholesterol absorption inhibitors	20131218
WO-2013055317-A1	Liquid crystals with switchable wettability for cell sorting	20111011
US-2008214547-A1	Methods and compositions of trail-death receptor agonists/activators	20070201
US-2011172234-A1	Methods and compositions of trail-death receptor agonists/activators	20070201
US-7915245-B2	Methods and compositions of trail-death receptor agonists/activators	20070201

PMID	Publication Date	Title	Journal
22832313	20120901	The antioxidant effect of imine resveratrol analogues	Bioorganic & medicinal chemistry letters
22412746	20120301	4-[(E)-(4-Methyl-phen-yl)imino-meth-yl]phenol	Acta crystallographica. Section E, Structure reports online

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	223
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.099714038
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	211.099714038
Rotatable Bond Count:	2
Topological Polar Surface Area:	32.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2