Structure

2-Chloro-1,3-dimethylbenzene

CAS
6781-98-2
Catalog Number
ACM6781982
Category
Aryl
Molecular Weight
140.61
Molecular Formula
C8H9Cl

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Specification

Synonyms
2-Chloro-m-xylene, m-Xylene, 2-chloro-, 2-Chloro-1,3-dimethylbenzene, Benzene, 2-chloro-1,3-dimethyl-, 276308_ALDRICH, EINECS 229-843-4, InChI=1/C8H9Cl/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H, 6781-98-2
IUPAC Name
2-chloro-1,3-dimethylbenzene
InChI Key
VDXLAYAQGYCQEO-UHFFFAOYSA-N
Boiling Point
182-183ºC
Melting Point
-36ºC
Flash Point
63ºC
Density
1.061
Appearance
Clear colourless to light yellow liquid
Exact Mass
140.03900
Hazard Statements
H315-H319-H335
H-Bond Acceptor
0
H-Bond Donor
0
Packing Group
I; II; III
RIDADR
UN 1993C 3 / PGIII
Safety Description
S23-S36/37
Stability
Stable at room temperature in closed containers under normal storage and handling conditions.
Symbol
GHS07
WGK Germany
3
What is the molecular formula of 2-Chloro-1,3-dimethylbenzene?

The molecular formula of 2-Chloro-1,3-dimethylbenzene is C8H9Cl.

What is the molecular weight of 2-Chloro-1,3-dimethylbenzene?

The molecular weight of 2-Chloro-1,3-dimethylbenzene is 140.61 g/mol.

What is the IUPAC name of 2-Chloro-1,3-dimethylbenzene?

The IUPAC name of 2-Chloro-1,3-dimethylbenzene is 2-chloro-1,3-dimethylbenzene.

What is the InChI of 2-Chloro-1,3-dimethylbenzene?

The InChI of 2-Chloro-1,3-dimethylbenzene is InChI=1S/C8H9Cl/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3.

What is the InChIKey of 2-Chloro-1,3-dimethylbenzene?

The InChIKey of 2-Chloro-1,3-dimethylbenzene is VDXLAYAQGYCQEO-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Chloro-1,3-dimethylbenzene?

The canonical SMILES of 2-Chloro-1,3-dimethylbenzene is CC1=C(C(=CC=C1)C)Cl.

What is the CAS number of 2-Chloro-1,3-dimethylbenzene?

The CAS number of 2-Chloro-1,3-dimethylbenzene is 6781-98-2.

What is the EC number of 2-Chloro-1,3-dimethylbenzene?

The EC number of 2-Chloro-1,3-dimethylbenzene is 229-843-4.

What is the DSSTox Substance ID of 2-Chloro-1,3-dimethylbenzene?

The DSSTox Substance ID of 2-Chloro-1,3-dimethylbenzene is DTXSID40218061.

Is 2-Chloro-1,3-dimethylbenzene a canonicalized compound?

Yes, 2-Chloro-1,3-dimethylbenzene is a canonicalized compound.

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