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27600

Caffeine

purum, anhydrous, ≥99.0% (HPLC)

Synonym(s):

1,3,7-Trimethylxanthine

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About This Item

Linear Formula:
CH3(CH3)C6H4N4O2
CAS Number:
58-08-2
Molecular Weight:
194.19
EC Number:
200-362-1
UNSPSC Code:
12352210
PubChem Substance ID:
329753003
Beilstein/REAXYS Number:
17705
MDL number:
MFCD00005758
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grade

purum

assay

≥99.0% (HPLC)

mp

233-238 °C, 234-236.5 °C (lit.)

SMILES string

CN1C(=O)N(C)c2ncn(C)c2C1=O

InChI

1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3

InChI key

RYYVLZVUVIJVGH-UHFFFAOYSA-N

Gene Information

Other Notes

Pharmacology and toxicology

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Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Codes

H302

Precautionary Statements

P264 - P270 - P301 + P312 - P501

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

WGK

WGK 1

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

PPE (personal protective equipment)

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

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