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About This Item
Empirical Formula (Hill Notation):
C15H12I3NO4
CAS Number:
Molecular Weight:
650.97
EC Number:
229-999-3
UNSPSC Code:
51111800
MDL number:
Beilstein/REAXYS Number:
2710227
assay
≥97.0% (sum of enantiomers, HPLC)
optical activity
[α]20/D +25±2°, c = 1% in ethanol/1 M HCl (2:1)
impurities
≤2% 3,5-diiodo thyronine, ≤2% thyroxine
mp
232-240 °C (dec.), 234-238 °C (lit.)
storage temp.
2-8°C
SMILES string
N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O
InChI
1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1
InChI key
AUYYCJSJGJYCDS-LBPRGKRZSA-N
Other Notes
Review: Thyroid hormone action at the nuclear level
signalword
Danger
hcodes
Hazard Classifications
STOT RE 1
target_organs
Thyroid,Cardio-vascular system,Kidney
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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