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2276-90-6
IOTALAMIC ACID
Name
IOTALAMIC ACID
Formula
C11 H9 I3 N2 O4
MolWeight
613.902
1Identification
【Name】
IOTALAMIC ACID
【CAS】
【MDL】
MFCD00800738
【English Synonyms】
【Formula】
C11 H9 I3 N2 O4
【MolWeight】
613.902
【Inchi】
InChI=1S/C11H9I3N2O4/c1-3(17)16-9-7(13)4(10(18)15-2)6(12)5(8(9)14)11(19)20/h1-2H3,(H,15,18)(H,16,17)(H,19,20)
【InChIKey】
InChIKey=UXIGWFXRQKWHHA-UHFFFAOYSA-N
【SMILES】
CC(=O)Nc1c(c(c(c(c1I)C(=O)O)I)C(=O)NC)I
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
IOTALAMIC ACID.cml
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Catalog No:K113 0.500G
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http://www.okscien.com
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