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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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

I11704-100G:
I11704-BULK:
I11704-25G:4548173990699
I11704-VAR:
I11704-5G:4548173990705

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Certificates of Analysis (COA)

Lot/Batch Number
MKCN1971
MKCG1786
MKBX1837V
MKBR7516V
MKBN7197V

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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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