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I11704

Sigma-Aldrich

2-Iodotoluene

98%

Synonym(s):

1-Iodo-2-methylbenzene

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About This Item

Linear Formula:
CH3C6H4I
CAS Number:
615-37-2
Molecular Weight:
218.03
Beilstein:
1634294
EC Number:
210-422-9
MDL number:
MFCD00001042
UNSPSC Code:
12352100
PubChem Substance ID:
24895921
NACRES:
NA.22

Quality Level

100

Assay

98%

form

liquid

refractive index

n20/D 1.608 (lit.)

bp

211 °C (lit.)

density

1.713 g/mL at 25 °C (lit.)

SMILES string

Cc1ccccc1I

InChI

1S/C7H7I/c1-6-4-2-3-5-7(6)8/h2-5H,1H3

InChI key

RINOYHWVBUKAQE-UHFFFAOYSA-N

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Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319

Precautionary Statements

P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

194.0 °F - closed cup

Flash Point(C)

90 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Sven Herbers et al.
Physical chemistry chemical physics : PCCP, 22(20), 11490-11497 (2020-05-12)
The internal rotation of methyl groups and nuclear quadrupole moments of the halogens Cl, Br, I in o-halotoluenes cause complex spectral fine and hyperfine structures in rotational spectra arising from angular momentum coupling. Building on the existing data regarding o-fluorotoluene

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