535948-16-4
2-CHLORO-5-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
2-CHLORO-5-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_formula
C18 H13 Br2 Cl N2 O4 S
pro_molWeight
548.638
1Identification
【Name】
2-CHLORO-5-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03572027
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C18 H13 Br2 Cl N2 O4 S
【pro_molWeight】
548.638
【Inchi】
InChI=1S/C18H13Br2ClN2O4S/c1-27-16-9(6-10(19)7-13(16)20)2-5-15(24)23-18(28)22-11-3-4-14(21)12(8-11)17(25)26/h2-8H,1H3,(H,25,26)(H2,22,23,24,28)/b5-2+
【InChIKey】
InChIKey=NOBSKBDAUAMZRM-GORDUTHDSA-N
【SMILES】
COc1c(cc(cc1Br)Br)/C=C/C(=O)NC(=S)Nc2ccc(c(c2)C(=O)O)Cl
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:3
pro_acceptors:6
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-CHLORO-5-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
quick_release
SuppliersList
AsisChem, Inc.
pro_catalogNo:U86369 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
More 535948-16-4 select_supply>>
pro_catalogNo:U86369 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
More 535948-16-4 select_supply>>