Structure

Phenol,2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]-

CAS
925233-23-4
Catalog Number
ACM925233234
Category
Other Products
Molecular Formula
C12H16ClNO2

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What is the molecular formula of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]?

The molecular formula is C12H16ClNO2.

What is the CID (Chemical Identifier) of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl] in PubChem?

The CID is 68451182.

When was phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl] created in PubChem?

It was created on November 30, 2012.

When was phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl] last modified in PubChem?

It was last modified on December 30, 2023.

What is the IUPAC Name of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]?

The IUPAC name is 2-chloro-3-[2-(methoxymethyl)pyrrolidin-1-yl]phenol.

What is the InChI (International Chemical Identifier) of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]?

The InChI is InChI=1S/C12H16ClNO2/c1-16-8-9-4-3-7-14(9)10-5-2-6-11(15)12(10)13/h2,5-6,9,15H,3-4,7-8H2,1H3.

What is the InChIKey of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]?

The InChIKey is LEKIGXUQKLGJHC-UHFFFAOYSA-N.

What is the Canonical SMILES (Simplified Molecular Input Line Entry System) of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]?

The Canonical SMILES is COCC1CCCN1C2=C(C(=CC=C2)O)Cl.

What is the molecular weight of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]?

The molecular weight is 241.71 g/mol.

What is the XLogP3-AA (Octanol/Water Partition Coefficient) value of phenol, 2-chloro-3-[2-(methoxymethyl)-1-pyrrolidinyl]?

The XLogP3-AA value is 2.7.

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