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2, 4,4'-[(3-Sulfo-4,4'-biphenylylene)bis(azo)]bis[3-amino-, pentasodium salt

HCID 73032
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Basic information

CAS
574-64-1
Standard SMILES
Nc1c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)ccc2c1N=Nc1ccc(-c2ccc(N=Nc3c(N)c(S(=O)(=O)O)cc4cc(S(=O)(=O)O)ccc34)c(S(=O)(=O)O)c2)cc1
InChIKey
CWWJGMXENHLBBV-UHFFFAOYSA-N
Molecular formula
C32H24N6O15S5
Average molar mass
892.9 g/mol
Monoisotopic mass
891.99031995

Names & identifiers

Preferred name
2, 4,4'-[(3-Sulfo-4,4'-biphenylylene)bis(azo)]bis[3-amino-, pentasodium salt
IUPAC
3-amino-4-[[4-[4-[(2-amino-3,6-disulfonaphthalen-1-yl)diazenyl]-3-sulfophenyl]phenyl]diazenyl]naphthalene-2,7-disulfonic acid
English name
TRYPAN RED
Molecular formula
C32H19N6Na5O15S5
Molecular weight
1002.8

Names & synonyms

CHEMBL1092090NSC11243NSC-11243BDBM503160762, 4,4'-[(3-sulfo-4,4'-biphenylylene)bis(azo)]bis[3-amino-, pentasodium salt2, 4,4'-[(3-sulfo[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[3-amino-, pentasodium salt4,4''-(3-sulfobiphenyl-4,4''-diyl)bis(diazene-2,1-diyl)bis(3-aminonaphthalene-2,7-disulfonic acid)CI 22850TRYPAN REDpentasodium 4,4'-[(3-sulphonato[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[3-aminonaphthalene-2,7-disulphonate]4,4'-[(3-Sodiosulfo[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis(3-amino-2,7-naphthalenedisulfonic acid disodium) salt

Database identifiers

CAS
574-64-1
PubChem CID
73032
ChEMBL
CHEMBL1092090

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
415 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
21
Rotatable bonds
10
Heavy atoms
58
Formal charge
0
Complexity
2,110

Physicochemical properties

form
Solid
color
Brown to black
CAS DataBase Reference
574 · 574-64-1
FDA UNII
2549 SX0N51 · 2549SX0N51

Chemistry & industry

Applications

UsesBiological stain.

Suppliers7 total

武汉易泰科技有限公司上海分公司18930552037 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海珈得尔化学技术有限公司13564435016 13564435016 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
重庆卡兰医药有限公司[email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]

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