533918-01-3
5-BROMO-2-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
5-BROMO-2-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_formula
C16 H12 Br N3 O6 S
pro_molWeight
454.256
1Identification
【Name】
5-BROMO-2-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03568822
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H12 Br N3 O6 S
【pro_molWeight】
454.256
【Inchi】
InChI=1S/C16H12BrN3O6S/c17-9-1-6-13(12(7-9)15(22)23)18-16(27)19-14(21)8-26-11-4-2-10(3-5-11)20(24)25/h1-7H,8H2,(H,22,23)(H2,18,19,21,27)
【InChIKey】
InChIKey=JUDJYQLVWKMXSY-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1[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-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
quick_release
SuppliersList
AsisChem, Inc.
pro_catalogNo:U81883 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
More 533918-01-3 select_supply>>
pro_catalogNo:U81883 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
More 533918-01-3 select_supply>>