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C.I. Pigment Red 63:2

HCID 94467
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Basic information

CAS
35355-77-2
Standard SMILES
O=C([O-])c1cc2ccccc2c(N=Nc2ccc3ccccc3c2S(=O)(=O)[O-])c1[O-].[H+].[Mn+2]
InChIKey
OERKJBNVFFNQPK-UHFFFAOYSA-L
Molecular formula
C21H12MnN2O6S
Average molar mass
475.3 g/mol
Monoisotopic mass
474.97965

Names & identifiers

Preferred name
C.I. Pigment Red 63:2
IUPAC
hydron;manganese(2+);3-oxido-4-[(1-sulfonatonaphthalen-2-yl)diazenyl]naphthalene-2-carboxylate

Names & synonyms

35355-77-2EINECS 308-914-4EINECS 252-525-1C.I. 15880:2EC 252-525-1DTXSID801014909Manganate(1-), (3-(hydroxy-kappaO)-4-(2-(1-(sulfo-kappaO)-2-naphthalenyl)diazenyl)-2-naphthalenecarboxylato(3-))-, hydrogen (1:1)Manganate(1-), [3-(hydroxy-kappaO)-4-[2-[1-(sulfo-kappaO)-2-naphthalenyl]diazenyl]-2-naphthalenecarboxylato(3-)]-, hydrogen (1:1)RefChem:572558DTXCID801473246Manganate(1-), [3-(hydroxy-.kappa.O)-4-[2-[1-(sulfo-.kappa.O)-2-naphthalenyl]diazenyl]-2-naphthalenecarboxylato(3-)]-, hydrogen (1:1)SCHEMBL21436359
Show more names
SCHEMBL29393847Manganate(1-), (3-(hydroxy-kappaO)-4-((1-(sulfo-kappaO)-2-naphthalenyl)azo)-2-naphthalenecarboxylato(3-))-, hydrogenManganese(2+) hydrogen 3-oxido-4-[(E)-(1-sulfonatonaphthalen-2-yl)diazenyl]naphthalene-2-carboxylate (1/1/1)

Database identifiers

CAS
35355-77-2
PubChem CID
94467
DTXSID
DTXSID801014909
EC Number
252-525-1

Properties

Computed structural properties

Topological polar surface area
153 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
31
Formal charge
0
Complexity
747

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% (130 of 130) of all reports.

Not Classified

Aggregated GHS information provided per 130 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

Chemical: Manganate(1-), [3-(hydroxy-.kappa.O)-4-[2-[1-(sulfo-.kappa.O)-2-naphthalenyl]diazenyl]-2-naphthalenecarboxylato(3-)]-, hydrogen (1:1)

REACH registered substance: Manganese, 3-hydroxy-4-[(1-sulfo-2-naphthalenyl)azo]-2-naphthalenecarboxylic acid complex (EC: 252-525-1)

Manganate(1-), 3-(hydroxy-.kappa.O)-4-1-(sulfo-.kappa.O)-2-naphthalenylazo-2-naphthalenecarboxylato(3-)-, hydrogen: 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.

Hazard Classes and CategoriesNot Classified

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationManganate(1-), [3-(hydroxy-.kappa.O)-4-[2-[1-(sulfo-.kappa.O)-2-naphthalenyl]diazenyl]-2-naphthalenecarboxylato(3-)]-, hydrogen (1:1): ACTIVE

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Compound notes

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