HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-Naphthalenesulfonic acid, 6-amino-5-(2-(4'-(((decyloxy)carbonyl)amino)-2,2'-dimethyl-5-sulfo(1,1'-biphenyl)-4-yl)diazenyl)-4-hydroxy-, sodium salt (1:2)

HCID 166182
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
71720-88-2
Standard SMILES
CCCCCCCCCCOC(=O)Nc1ccc(-c2cc(S(=O)(=O)[O-])c(N=Nc3c(N)ccc4cc(S(=O)(=O)[O-])cc(O)c34)cc2C)c(C)c1.[Na+].[Na+]
InChIKey
GQXXWVTVJFAQTL-UHFFFAOYSA-L
Molecular formula
C35H40N4Na2O9S2
Average molar mass
770.8 g/mol
Monoisotopic mass
770.20320978

Names & identifiers

Preferred name
2-Naphthalenesulfonic acid, 6-amino-5-(2-(4'-(((decyloxy)carbonyl)amino)-2,2'-dimethyl-5-sulfo(1,1'-biphenyl)-4-yl)diazenyl)-4-hydroxy-, sodium salt (1:2)
IUPAC
disodium;6-amino-5-[[4-[4-(decoxycarbonylamino)-2-methylphenyl]-5-methyl-2-sulfonatophenyl]diazenyl]-4-hydroxynaphthalene-2-sulfonate

Names & synonyms

EINECS 275-915-371720-88-2DTXSID308901532-Naphthalenesulfonic acid, 6-amino-5-((4'-(((decyloxy)carbonyl)amino)-2,2'-dimethyl-5-sulfo(1,1'-biphenyl)-4-yl)azo)-4-hydroxy-, disodium salt2-Naphthalenesulfonic acid, 6-amino-5-(2-(4'-(((decyloxy)carbonyl)amino)-2,2'-dimethyl-5-sulfo(1,1'-biphenyl)-4-yl)diazenyl)-4-hydroxy-, sodium salt (1:2)2-Naphthalenesulfonic acid, 6-amino-5-[[4'-[[(decyloxy)carbonyl]amino]-2,2'-dimethyl-5-sulfo[1,1'-biphenyl]-4-yl]azo]-4-hydroxy-, disodium salt2-Naphthalenesulfonic acid, 6-amino-5-[2-[4'-[[(decyloxy)carbonyl]amino]-2,2'-dimethyl-5-sulfo[1,1'-biphenyl]-4-yl]diazenyl]-4-hydroxy-, sodium salt (1:2)Carbamic acid, (4'-((2-amino-8-hydroxy-6-sulfo-1-naphthalenyl)azo)-2,2'-dimethyl-5'-sulfo(1,1'-biphenyl)-4-yl)-, C-decyl ester, disodium saltRefChem:88561DTXCID701079071WHDUCGOSDLJCAQ-UHFFFAOYSA-LNS00123412
Show more names
Disodium 4-[(2-amino-8-hydroxy-6-sulfonatonaphthalen-1-yl)diazenyl]-4'-{[(decyloxy)carbonyl]amino}-2',6-dimethyl[1,1'-biphenyl]-3-sulfonateDisodium C-decyl (4'-((2-amino-8-hydroxy-6-sulphonato-1-naphthyl)azo)-2,2'-dimethyl-5'-sulphonato(1,1'-biphenyl)-4-yl)carbamate

Properties

Computed structural properties

Topological polar surface area
240 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
12
Rotatable bonds
14
Heavy atoms
52
Formal charge
0
Complexity
1,300

Safety & regulation

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

Hazard information

Regulatory InformationChemical: Carbamic acid, [4'-[(2-amino-8-hydroxy-6-sulfo-1-naphthalenyl)azo]-2,2'-dimethyl-5'-sulfo[1,1'-biphenyl]-4-yl]-, C-decyl ester, disodium salt
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Naphthalenesulfonic acid, 6-amino-5-[2-[4'-[[(decyloxy)carbonyl]amino]-2,2'-dimethyl-5-sulfo[1,1'-biphenyl]-4-yl]diazenyl]-4-hydroxy-, sodium salt (1:2): INACTIVE

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
71720-88-2
PubChem CID
166182
DTXSID
DTXSID30890153
EC Number
275-915-3