(S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)

CAS

133095-74-6

Catalog Number

ACM133095746

Category

Main Products

Molecular Weight

242.29

Molecular Formula

C11H14O4S

MSDS COA Spec Sheet

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

Specification

Synonyms

[(2S)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate

Appearance

Faint Brown to Dark Brown powder

What is the molecular formula of (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)?

The molecular formula is C11H14O4S.

What are the synonyms for (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)?

The synonyms are:
(S)-3-Butene-1,2-diol-1-(p-toluenesulfonate)
(S)-1-Tosyloxy-3-buten-1-ol
3-Butene-1,2-diol, 1-(4-methylbenzenesulfonate), (2S)-
[(2S)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate

What is the molecular weight of (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)?

The molecular weight is 242.29 g/mol.

When was (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate) created?

It was created on July 29, 2006.

When was (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate) last modified?

It was last modified on October 21, 2023.

What is the IUPAC name of (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)?

The IUPAC name is [(2S)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate.

What is the InChI of (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)?

The InChI is InChI=1S/C11H14O4S/c1-3-10(12)8-15-16(13,14)11-6-4-9(2)5-7-11/h3-7,10,12H,1,8H2,2H3/t10-/m0/s1.

What is the InChIKey of (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)?

The InChIKey is YQSCDBZHHLIPOI-JTQLQIEISA-N.

What are the computed properties of (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate)?

The computed properties are:
XLogP3: 1.4
Hydrogen Bond Donor Count: 1
Hydrogen Bond Acceptor Count: 4
Rotatable Bond Count: 5
Exact Mass: 242.06128010 g/mol
Topological Polar Surface Area: 72Å²
Heavy Atom Count: 16

Is (S)-3-Butene-1,2-Diol-1-(P-Toluenesulfonate) canonicalized?

Yes, it is canonicalized.

Recommended Products