1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid

CAS
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CAS
43129-41-5
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Purity
96%
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Catalog Number

ACM43129415

Product Name

1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid

Structure

Structure

CAS

43129-41-5

Category

Ethers

Synonyms

1-(3,4-dimethoxyphenyl)cyclopentanecarboxylic acid, 43129-41-5, ST064965, BAS 00700617, AC1LFES6, AC1Q5UJK, AC1Q4C7D, Oprea1_588903, Oprea1_622815, CTK4I7046, MolPort-001-943-692, HMS1678M02, KST-1B4293, AR-1B1253, STK996137, AKOS000547456, AG-F-52982, MCULE-8809508714, AK-97944, AB1008879

IUPAC Name

1-(3,4-dimethoxyphenyl)cyclopentane-1-carboxylic acid

Molecular Weight

250.29

Molecular Formula

C₁₄H₁₇NO₂

Canonical SMILES

COC1=C(C=C(C=C1)C2(CCCC2)C(=O)O)OC

InChI Key

XKZPEWPCGQOEIS-UHFFFAOYSA-N

Boiling Point

403.7ºC at 760 mmHg

Flash Point

150.5ºC

Density

1.182g/cm³

Exact Mass

250.12100

Hazard Statements

H302-H318

H-Bond Acceptor

4

H-Bond Donor

1

RIDADR

UN 2811 6.1 / PGIII

Symbol

GHS05

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The molecular formula is C14H18O4.

When was 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid created?

It was created on July 8, 2005.

What is the IUPAC name of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The IUPAC name is 1-(3,4-dimethoxyphenyl)cyclopentane-1-carboxylic acid.

What is the InChI of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The InChI is InChI=1S/C14H18O4/c1-17-11-6-5-10(9-12(11)18-2)14(13(15)16)7-3-4-8-14/h5-6,9H,3-4,7-8H2,1-2H3,(H,15,16).

What is the InChIKey of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The InChIKey is XKZPEWPCGQOEIS-UHFFFAOYSA-N.

What is the canonical SMILES of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The canonical SMILES is COC1=C(C=C(C=C1)C2(CCCC2)C(=O)O)OC.

What is the CAS number of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The CAS number is 43129-41-5.

What is the molecular weight of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The molecular weight is 250.29 g/mol.

What is the XLogP3-AA value of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The XLogP3-AA value is 2.8.

What is the hydrogen bond donor count of 1-(3,4-Dimethoxyphenyl)cyclopentanecarboxylic acid?

The hydrogen bond donor count is 1.

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