535947-18-3
5-BROMO-2-[[[[(2-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
5-BROMO-2-[[[[(2-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_formula
C16 H12 Br N3 O6 S
pro_molWeight
454.256
1Identification
【Name】
5-BROMO-2-[[[[(2-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03571942
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H12 Br N3 O6 S
【pro_molWeight】
454.256
【Inchi】
InChI=1S/C16H12BrN3O6S/c17-9-5-6-11(10(7-9)15(22)23)18-16(27)19-14(21)8-26-13-4-2-1-3-12(13)20(24)25/h1-7H,8H2,(H,22,23)(H2,18,19,21,27)
【InChIKey】
InChIKey=VVUCKSCYUGBEEZ-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)[N+](=O)[O-])OCC(=O)NC(=S)Nc2ccc(cc2C(=O)O)Br
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:3
pro_acceptors:9
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-BROMO-2-[[[[(2-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
quick_release
SuppliersList
AsisChem, Inc.
pro_catalogNo:U82234 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
More 535947-18-3 select_supply>>
pro_catalogNo:U82234 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
More 535947-18-3 select_supply>>