536983-41-2
3-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-BENZOIC ACID
Name
3-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-BENZOIC ACID
Formula
C15 H8 Br Cl I2 N2 O3 S
MolWeight
665.462
1Identification
【Name】
3-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-BENZOIC ACID
【CAS】
【MDL】
MFCD03573656
【English Synonyms】
【Formula】
C15 H8 Br Cl I2 N2 O3 S
【MolWeight】
665.462
【Inchi】
InChI=1S/C15H8BrClI2N2O3S/c16-12-8(4-7(18)5-10(12)19)13(22)21-15(25)20-11-3-6(14(23)24)1-2-9(11)17/h1-5H,(H,23,24)(H2,20,21,22,25)
【InChIKey】
InChIKey=IPDKEBXCUNMCHW-UHFFFAOYSA-N
【SMILES】
c1cc(c(cc1C(=O)O)NC(=S)NC(=O)c2cc(cc(c2Br)I)I)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[[[(2-BROMO-3,5-DIIODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-BENZOIC ACID.cml
Quick Release
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Catalog No:U78593 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.AsisChem.com
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