532407-19-5
2-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
2-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula
C15 H9 Br I2 N2 O3 S
MolWeight
631.017
1Identification
【Name】
2-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03567720
【English Synonyms】
【Formula】
C15 H9 Br I2 N2 O3 S
【MolWeight】
631.017
【Inchi】
InChI=1S/C15H9BrI2N2O3S/c16-12-9(5-7(17)6-10(12)18)13(21)20-15(24)19-11-4-2-1-3-8(11)14(22)23/h1-6H,(H,22,23)(H2,19,20,21,24)
【InChIKey】
InChIKey=GPVGTJMVSXZWHR-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C(=O)O)NC(=S)NC(=O)c2cc(cc(c2Br)I)I
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
Quick Release
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Catalog No:U89165 nullnull
Catalog No:U83195 nullnull
Country/Region:United States
Business Type:Trading Company
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