3-(1-Piperidylmethyl)aniline - CAS 93138-55-7

Catalog:	BB040786
Product Name:	3-(1-Piperidylmethyl)aniline
CAS:	93138-55-7
Synonyms:	3-(1-piperidinylmethyl)aniline; 3-(piperidin-1-ylmethyl)aniline

Technical Data

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Computed Properties

IUPAC Name:	3-(piperidin-1-ylmethyl)aniline
Description:	3-(1-Piperidylmethyl)aniline (CAS# 93138-55-7) is a useful research chemical.
Molecular Weight:	190.28
Molecular Formula:	C12H18N2
Canonical SMILES:	C1CCN(CC1)CC2=CC(=CC=C2)N
InChI:	InChI=1S/C12H18N2/c13-12-6-4-5-11(9-12)10-14-7-2-1-3-8-14/h4-6,9H,1-3,7-8,10,13H2
InChI Key:	SEJNYLBEEMVJNN-UHFFFAOYSA-N
MDL:	MFCD04114502
LogP:	2.77380

Publication Number	Title	Priority Date
US-2021174983-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
WO-2021112933-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
TW-201904613-A	Quaternary alkalization nicotine indoleamine dinucleotide salvage synthetic inhibitor conjugate	20170427
CN-107698538-B	Preparation method of intermediate 3- (1-piperidinylmethyl) phenol of roxatidine acetate hydrochloride	20161130
TW-201818970-A	Targeted delivery of nicotinic adenine dinucleotide dinucleotide remedial synthesis (SALVAGE PATHWAY) inhibitor	20161018

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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:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.146998583
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	190.146998583
Rotatable Bond Count:	2
Topological Polar Surface Area:	29.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5