535938-13-7
5-IODO-2-[[[(2-METHYL-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
5-IODO-2-[[[(2-METHYL-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_formula
C16 H12 I N3 O5 S
pro_molWeight
485.253
1Identification
【Name】
5-IODO-2-[[[(2-METHYL-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03571358
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H12 I N3 O5 S
【pro_molWeight】
485.253
【Inchi】
InChI=1S/C16H12IN3O5S/c1-8-10(3-2-4-13(8)20(24)25)14(21)19-16(26)18-12-6-5-9(17)7-11(12)15(22)23/h2-7H,1H3,(H,22,23)(H2,18,19,21,26)
【InChIKey】
InChIKey=JTYVSZVHKJPBSY-UHFFFAOYSA-N
【SMILES】
Cc1c(cccc1[N+](=O)[O-])C(=O)NC(=S)Nc2ccc(cc2C(=O)O)I
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:3
pro_acceptors:8
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-IODO-2-[[[(2-METHYL-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
quick_release
SuppliersList
AsisChem, Inc.
pro_catalogNo:U85424 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
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pro_catalogNo:U85424 nullnull
CountryRegion:US
BusinessType:TradingCompany
http://www.AsisChem.com
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