Butanoic acid,4,4,4-trifluoro-3-hydroxy-2-methyl-,ethyl ester

CAS
Size
Purity
Price
Availability
Quantity
Order

CAS
91600-33-8
Size
---
Purity
96%
Price
---
Availability
Inquiry
Quantity
Order
Online Inquiry

If you have any other questions or need other size, please get a quote.

Catalog Number

ACM91600338

Product Name

Butanoic acid,4,4,4-trifluoro-3-hydroxy-2-methyl-,ethyl ester

Structure

Structure

CAS

91600-33-8

Category

Heterocyclic Organic Compound

Synonyms

Ethyl 2-methyl-3-hydroxy-4,4,4-trifluorobutyrate, Ethyl 4,4,4-trifluoro-3-hydroxy-2-methylbutanoate, 91600-33-8, ST50825444, ethyl-4,4,4-trifluor-3-hydroxy-2-methylbutanoat, ethyl 2-methyl-4,4,4-trifluoro-3-hydroxybutanoate, AC1LBDMA, AC1Q4IHA, CTK5C1922, MolPort-000-155-299, AR-1J0584, SBB092570, AKOS006223453, AG-G-44011, AG-K-76051, MCULE-2441490637, KB-50953, TL8005873, FT-0625965, ethyl 3-hydroxy-2-methyl-4,4,4-trifluorobutyrate

IUPAC Name

ethyl 4,4,4-trifluoro-3-hydroxy-2-methylbutanoate

Molecular Weight

200.1556

Molecular Formula

C₇H₁₁F₃O₃

Canonical SMILES

CCOC(=O)C(C)C(C(F)(F)F)O

InChI Key

MFRIOKNLYRUYHP-UHFFFAOYSA-N

Boiling Point

180ºC

Flash Point

87.2ºC

Density

1.233 g/cm³

Exact Mass

200.06600

Hazard Statements

Xi

H-Bond Acceptor

6

H-Bond Donor

1

Safety Description

S26-S36

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of the compound?

The molecular formula of the compound is C7H11F3O3.

What is the molecular weight of the compound?

The molecular weight of the compound is 200.16 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is ethyl 4,4,4-trifluoro-3-hydroxy-2-methylbutanoate.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C7H11F3O3/c1-3-13-6(12)4(2)5(11)7(8,9)10/h4-5,11H,3H2,1-2H3.

What is the InChIKey of the compound?

The InChIKey of the compound is MFRIOKNLYRUYHP-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is CCOC(=O)C(C)C(C(F)(F)F)O.

What is the CAS number of the compound?

The CAS number of the compound is 649-56-9.

What is the EC number of the compound?

The EC number of the compound is 670-546-8.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 1.5.

Is the compound canonicalized?

Yes, the compound is canonicalized according to PubChem.

※ Please kindly note that our products are for research use only.

Discover More

Chemical Fluorescence Probe

Chemical Fluorescence Probe

Dyes

Dyes

Fluorinated Building Blocks

Fluorinated Building Blocks

Heterocyclic Organic Compound

Heterocyclic Organic Compound

Insect Pheromone

Insect Pheromone

Ionic Liquids

Ionic Liquids

Lipid Compounds

Lipid Compounds

Main Products

Main Products

Contact Us

For product inquiries, please use our online system or send an email to .

Download

* I hereby give my consent that I may receive marketing e-mails with information on existing and new services from this company. I know that I can opt-out from receiving such e-mails at any time or by using the link which will be provided in each marketing e-mail.

qrcode