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4,4'-Stilbenedicarboxamidine, 2-hydroxy-

HCID 3654
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
495-99-8
Standard SMILES
N=C(N)c1ccc(C=Cc2ccc(C(=N)N)cc2O)cc1
InChIKey
TUESWZZJYCLFNL-UHFFFAOYSA-N
Molecular formula
C16H16N4O
Average molar mass
280.32 g/mol
Monoisotopic mass
280.13241115

Names & identifiers

Preferred name
4,4'-Stilbenedicarboxamidine, 2-hydroxy-
IUPAC
4-[2-(4-carbamimidoylphenyl)ethenyl]-3-hydroxybenzenecarboximidamide
English name
bis(8-hydroxyquinolinium) sulphate
Molecular formula
C16H16N4O
Molecular weight
280.32

Names & synonyms

4-(4-Carbamimidoylstyryl)-3-hydroxybenzimidamideOHSABenzenecarboximidamide, 4-(2-(4-(aminoiminomethyl)phenyl)ethenyl)-3-hydroxy-Benzenecarboximidamide, 4-[2-[4-(aminoiminomethyl)phenyl]ethenyl]-3-hydroxy-Idrossistilbamidina [DCIT]SCHEMBL871252Hydroxystilbamidine [INN:BAN]CHEMBL530274orb1685198orb2900246SCHEMBL8482349SCHEMBL29439031
Show more names
2-Hydroxy-4,4'-stilbenedicarboxamidineHydroxystilbamidine (DNA/RNA-binding dye)bis(8-hydroxyquinolinium) sulphate USP/EP/BP
UNII-39J262E49WHydroxystilbamidinum [INN-Latin]BDJMVMHFNPSEOL-NYYWCZLTSA-NHidroxiestilbamidina [INN-Spanish]EINECS 207-811-02-Hydroxystilbene-4,4'-dicarboxamidineBRN 27009192-hydroxy-4,4'-stilbene dicarboxamidine

Database identifiers

CAS
495-99-8
PubChem CID
3654
DTXSID
DTXSID3023136
ChEMBL
CHEMBL530274

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
120 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
413

Physicochemical properties

Melting point
235 ° · 235°
FDA UNII
39 J262E49W · 39J262E49W
Toxicity
50 in · LD50 in mice (mg/g); 0.027 i.v.; 0.14 s.c. (Ewins, 1950)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Toxicity
LD50 in mice (mg/g); 0.027 i.v.; 0.14 s.c. (Ewins, 1950)

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Hydrochloric acidSodium nitrateSulfuric acid4-Methyl-2-nitrobenzonitrile2-Hydroxyethanesulphonic acidAmmoniaStannous chloride4-Cyanobenzaldehyde

Suppliers11 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]

Additional notes

DefinitionChEBI: Hydroxystilbamidine is a stilbenoid.