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6-Amino-5-((3-((ethylphenylamino)sulphonyl)-4-methylphenyl)azo)-4-hydroxynaphthalene-2-sulphonic acid

HCID 166164
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
12217-35-5
Standard SMILES
CCN(c1ccccc1)S(=O)(=O)c1cc(N=Nc2c(N)ccc3cc(S(=O)(=O)O)cc(O)c23)ccc1C
InChIKey
JQNSWTWZESAPPA-UHFFFAOYSA-N
Molecular formula
C25H24N4O6S2
Average molar mass
540.6 g/mol
Monoisotopic mass
540.11372685

Names & identifiers

Preferred name
6-Amino-5-((3-((ethylphenylamino)sulphonyl)-4-methylphenyl)azo)-4-hydroxynaphthalene-2-sulphonic acid
IUPAC
6-amino-5-[[3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl]diazenyl]-4-hydroxynaphthalene-2-sulfonic acid
English name
Acid Red 118
Molecular formula
C25H24N4O6S2
Molecular weight
0

Names & synonyms

ACID RED 118EINECS 280-149-86-Amino-5-((3-((ethylphenylamino)sulphonyl)-4-methylphenyl)azo)-4-hydroxynaphthalene-2-sulphonic acidDTXSID2013178402-Naphthalenesulfonic acid, 6-amino-5-((3-((ethylphenylamino)sulfonyl)-4-methylphenyl)azo)-4-hydroxy-6-amino-5-[[3-[(ethylphenylamino)sulphonyl]-4-methylphenyl]azo]-4-hydroxynaphthalene-2-sulphonic acid2-Naphthalenesulfonic acid, 6-amino-5-[[3-[(ethylphenylamino)sulfonyl]-4-methylphenyl]azo]-4-hydroxy-RefChem:540263DTXCID2010637102-Naphthalenesulfonic acid, 6-amino-5-3-(ethylphenylamino)sulfonyl-4-methylphenylazo-4-hydroxy-280-149-8C.I. Acid Red 118
Show more names
Red GWAcid red 118 (C.I. 26410)Acid Red 118 ISO 9001:2015 REACH
12217-35-583027-46-76-amino-5-[[3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl]diazenyl]-4-hydroxynaphthalene-2-sulfonic acid6-Amino-5-({3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonic acidSCHEMBL29384857DTXSID70924103JQNSWTWZESAPPA-UHFFFAOYSA-NNS00020943

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
179 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
10
Rotatable bonds
7
Heavy atoms
37
Formal charge
0
Complexity
1,010

Safety & regulation

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

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (45 of 45) of all reports.

Not Classified

Aggregated GHS information provided per 45 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 2 items

Chemical: 2-Naphthalenesulfonic acid, 6-amino-5-[[3-[(ethylphenylamino)sulfonyl]-4-methylphenyl]azo]-4-hydroxy-

2-Naphthalenesulfonic acid, 6-amino-5-3-(ethylphenylamino)sulfonyl-4-methylphenylazo-4-hydroxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - 2-Naphthalenesulfonic acid, 6-amino-5-[[3-[(ethylphenylamino)sulfonyl]-4-methylphenyl]azo]-4-hydroxy-: Human health tier I assessment
Hazard Classes and CategoriesNot Classified

Chemistry & industry

Suppliers1 total

广州市海珠区正鸿商行020-82550624 13016020539 · [email protected]

Related reactions

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Compound notes

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

Database identifiers

CAS
12217-35-5、83027-46-7
PubChem CID
166164
DTXSID
DTXSID201317840
EC Number
280-149-8、601-872-0
Nikkaji
J278.746F