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Structure

4-Methyl-2,3,5,6-tetrafluorobenzyl bromide

CAS
92814-00-1
Catalog Number
ACM92814001
Category
Aryl
Molecular Weight
257.02
Molecular Formula
C6H2Cl4

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Specification

Synonyms
556491_ALDRICH, ALBB-006973, STK504222, CID2778368, 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide, T194, 1-(bromomethyl)-2,3,5,6-tetrafluoro-4-methylbenzene, 1-Bromomethyl-4-methyl-2,3,5,6-tetrafluorobenzene, 1-(bromomethyl)-2,3,5,6-tetrafluoro-4-methyl-benzene, 92814-00-1
IUPAC Name
1-(bromomethyl)-2,3,5,6-tetrafluoro-4-methylbenzene
Canonical SMILES
CC1=C(C(=C(C(=C1F)F)CBr)F)F
InChI Key
JGBVMYAEIPKDQB-UHFFFAOYSA-N
Boiling Point
49ºC 0,4mm
Melting Point
38.5-42.5ºC
Flash Point
97.3ºC
Density
1.69g/cm³
Exact Mass
255.95100
Hazard Statements
H302
H-Bond Acceptor
4
H-Bond Donor
0
Packing Group
II
RIDADR
UN 3261 8 / PGII
Safety Description
S26-S36/37/39-S45
Symbol
GHS07
WGK Germany
3
What is the molecular formula of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The molecular formula of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is C8H5BrF4.

What is the molecular weight of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The molecular weight of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is 257.02 g/mol.

What is the IUPAC name of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The IUPAC name of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is 1-(bromomethyl)-2,3,5,6-tetrafluoro-4-methylbenzene.

What is the InChI of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The InChI of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is InChI=1S/C8H5BrF4/c1-3-5(10)7(12)4(2-9)8(13)6(3)11/h2H2,1H3.

What is the InChIKey of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The InChIKey of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is JGBVMYAEIPKDQB-UHFFFAOYSA-N.

What is the Canonical SMILES of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The Canonical SMILES of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is CC1=C(C(=C(C(=C1F)F)CBr)F)F.

What is the CAS number of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The CAS number of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is 92814-00-1.

What is the European Community (EC) Number of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The European Community (EC) Number of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is 621-577-0.

What is the XLogP3-AA value of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide?

The XLogP3-AA value of 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is 3.2.

Is 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide a canonicalized compound?

Yes, 4-Methyl-2,3,5,6-tetrafluorobenzyl bromide is a canonicalized compound.

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