(R)-2-(1-(tert-Butoxycarbonyl)piperidin-3-yl)acetic acid

CAS

912940-89-7

Catalog Number

ACM912940897

Category

Other Products

Molecular Weight

243.29

Molecular Formula

C₁₂H₂₁NO₄

MSDS COA Spec Sheet

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Specification

Synonyms

912940-89-7, (R)-2-(1-(TERT-BUTOXYCARBONYL)PIPERIDIN-3-YL)ACETIC ACID, (R)-N-Boc-3-piperidineacetic acid, (R)-1-Boc-3-Piperidine acetic acid, (R)-(N-BOC-PIPERIDIN-3-YL)ACETIC ACID, PubChem11662, SureCN1225792, AC1LT439, CTK8B4873, MolPort-003-725-553, (R)-1-Boc-3-Piperidineacetic Acid, ANW-46580, RW1091, AKOS007930783, AB13358, N-BOC-(3R)-PIP(3-CH2COOH), QC-7310, AK-86645, KB-209697, (R)-1-BOC-PIPERIDINE-3-ACETIC ACID

IUPAC Name

2-[(3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]acetic acid

Canonical SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CC(=O)O

InChI Key

QZYGREZDLJVVSV-SECBINFHSA-N

Boiling Point

372.973ºC at 760 mmHg

Flash Point

179.368ºC

Density

1.122g/cm³

Exact Mass

243.14700

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of the compound?

The molecular formula of the compound is C12H21NO4.

When was the compound first created and last modified?

The compound was first created on July 11, 2005, and last modified on December 30, 2023.

What are some synonyms of the compound?

Some synonyms of the compound include (R)-2-(1-(TERT-BUTOXYCARBONYL)PIPERIDIN-3-YL)ACETIC ACID, (R)-(1-BOC-PIPERIDIN-3-YL)-ACETIC ACID, and 2-[(3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]acetic acid.

What is the molecular weight of the compound?

The molecular weight of the compound is 243.30 g/mol.

What is the Canonical SMILES of the compound?

The Canonical SMILES of the compound is CC(C)(C)OC(=O)N1CCCC(C1)CC(=O)O.

What is the InChIKey of the compound?

The InChIKey of the compound is QZYGREZDLJVVSV-SECBINFHSA-N.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 1.4.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 66.8 Å2.