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Structure

1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester

CAS
916078-39-2
Catalog Number
ACM916078392
Category
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What is the molecular formula of 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester?

The molecular formula is C8H15NO3.

What is the PubChem CID for 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester?

The PubChem CID is 45123042.

What is the IUPAC name of 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester?

The IUPAC name is methyl 4-(hydroxymethyl)piperidine-1-carboxylate.

What is the InChI of 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester?

The InChI is InChI=1S/C8H15NO3/c1-12-8(11)9-4-2-7(6-10)3-5-9/h7,10H,2-6H2,1H3.

What is the InChIKey of 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester?

The InChIKey is XITRBDLPZVGVDX-UHFFFAOYSA-N.

What is the molecular weight of 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester?

The molecular weight is 173.21 g/mol.

What is the XLogP3-AA value of 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester?

The XLogP3-AA value is 0.2.

How many hydrogen bond donor count does 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester have?

It has one hydrogen bond donor count.

How many hydrogen bond acceptor count does 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester have?

It has three hydrogen bond acceptor count.

How many rotatable bond count does 1-Piperidinecarboxylic acid,4-(hydroxymethyl)-,methyl ester have?

It has two rotatable bond count.

Upstream Synthesis Route 1

  • 6457-49-4
  • 79-22-1
  • 916078-39-2

Reference: [1] Patent: US2006/270652, 2006, A1, . Location in patent: Page/Page column 25-26

Upstream Synthesis Route 2

  • 6457-49-4
  • 79-22-1
  • 916078-39-2

Reference: [1]Patent: US2006/270652,2006,A1 .Location in patent: Page/Page column 25-26

Downstream Synthesis Route 1

  • 916078-39-2
  • 916078-41-6

Reference: [1]Patent: US2006/270652,2006,A1 .Location in patent: Page/Page column 26

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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