2-(1-Boc-4-piperidinyl)benzoic Acid - CAS 170838-26-3

Catalog:	BB012676
Product Name:	2-(1-Boc-4-piperidinyl)benzoic Acid
CAS:	170838-26-3
Synonyms:	2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinyl]benzoic acid; 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]benzoic acid

Technical Data

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Computed Properties

IUPAC Name:	2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]benzoic acid
Description:	2-(1-Boc-4-piperidinyl)benzoic Acid (CAS# 170838-26-3 ) is a useful research chemical.
Molecular Weight:	305.37
Molecular Formula:	C17H23NO4
Canonical SMILES:	CC(C)(C)OC(=O)N1CCC(CC1)C2=CC=CC=C2C(=O)O
InChI:	InChI=1S/C17H23NO4/c1-17(2,3)22-16(21)18-10-8-12(9-11-18)13-6-4-5-7-14(13)15(19)20/h4-7,12H,8-11H2,1-3H3,(H,19,20)
InChI Key:	NPKPUCNATSURJQ-UHFFFAOYSA-N
LogP:	3.43720

Publication Number	Title	Priority Date
WO-2021124172-A1	3-(5-methoxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione derivatives and uses thereof	20191218
US-10640467-B2	Process for preparing 2-(1-(tert-butoxycarbonyl)piperidine-4-yl)benzoic acid	20180601
US-2019367455-A1	PROCESS FOR PREPARING 2-(1-(tert-BUTOXYCARBONYL)PIPERIDINE-4-YL)BENZOIC ACID	20180601
WO-2019232010-A1	PROCESS FOR PREPARING 2-(1-(tert-BUTOXYCARBONYL)PIPERIDINE-4-YL)BENZOIC ACID	20180601
CN-112204007-A	Process for the preparation of 2- (1- (tert-butoxycarbonyl) piperidin-4-yl) benzoic acid	20180601

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Complexity:	407
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	305.16270821
Formal Charge:	0
Heavy Atom Count:	22
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	305.16270821
Rotatable Bond Count:	4
Topological Polar Surface Area:	66.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9