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Structure

1-Ethynyl-2,4,5-trimethylbenzene

CAS
351002-92-1
Catalog Number
ACM351002921
Category
Alkynes
Molecular Weight
144.21
Molecular Formula
C11H12

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Specification

Hazard Statements
H315-H319-H335
RIDADR
UN 1993C 3 / PGIII
Symbol
GHS07
What is the molecular formula of 1-Ethynyl-2,4,5-trimethylbenzene?

The molecular formula is C11H12.

What is the molecular weight of 1-Ethynyl-2,4,5-trimethylbenzene?

The molecular weight is 144.21 g/mol.

When was 1-Ethynyl-2,4,5-trimethylbenzene created?

It was created on July 12, 2007.

When was 1-Ethynyl-2,4,5-trimethylbenzene last modified?

It was last modified on November 25, 2023.

What is the IUPAC name of 1-Ethynyl-2,4,5-trimethylbenzene?

The IUPAC name is 1-ethynyl-2,4,5-trimethylbenzene.

What is the InChI of 1-Ethynyl-2,4,5-trimethylbenzene?

The InChI is InChI=1S/C11H12/c1-5-11-7-9(3)8(2)6-10(11)4/h1,6-7H,2-4H3.

What is the InChIKey of 1-Ethynyl-2,4,5-trimethylbenzene?

The InChIKey is FXHLQHXVJWYAGQ-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Ethynyl-2,4,5-trimethylbenzene?

The canonical SMILES is CC1=CC(=C(C=C1C)C#C)C.

Does 1-Ethynyl-2,4,5-trimethylbenzene have a CAS number?

Yes, the CAS number is 351002-92-1.

What is the XLogP3-AA value for 1-Ethynyl-2,4,5-trimethylbenzene?

The XLogP3-AA value is 3.3.

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