C.I. Acid Red 114 (disodium Salt)

Type: Chemical salt
CAS: 6459-94-5
EC: 229-272-0
Origin: EF 3.1 hybrid_name_cas_v1
Changes: 60 across every transformer

1,3-Naphthalenedisulfonic acid, 8-[2-[3,3′-dimethyl-4′-[2-[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]diazenyl][1,1′-biphenyl]-4-yl]diazenyl]-7-hydroxy-, sodium salt (1:2)
1,3-Naphthalenedisulfonic acid, 8-[[3,3′-dimethyl-4′-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]azo][1,1′-biphenyl]-4-yl]azo]-7-hydroxy-, disodium salt
Acid Leather Red BG
Acid Milling Red BS
Acid Milling Red RS
Acid Red 114
Acid Red F-RS
Acid Red P-RS
Acid Red RS
Amacid Milling Red PRS
Anadurm Red M-R
Apollo Nylon Fast Red R
Atul Acid Milling Red RS
Benzyl Fast Red BG
Benzyl Red BR
Best Acid Milling Red RS
C.I. Acid Red 114
C.I. Acid Red 114, disodium salt
Colomill Red RS
Concorde Acid Red M-RS
Concorde Leather Red RSN
Covalene Red RS
Covalene Scarlet RS
Covanyl Scarlet RS
Daedo Acid Red RS
Dinacid Milling Red RG
Dycosweak Acid RS
Eniacid Fast Red R
Erionyl Red RS
Erionyl Red RS 125
Everacid Milling Red RS
Everlan Red RS
Fabracid Red M-RS
Fenafor Red PB
Folan Red B
Indacid Milling Red RS
Kayanol Milling Red RS
Kayanol Milling Red RS 125
Kenamide Red K 2R
Kenanthrol Red R
Leather Fast Red B
Lerui Acid Red F-RS
Levanol Red GG
Midlon Red PRS
Milling Fast Red B
Milling Fast Red R
Milling Red B
Milling Red BB
Milling Red SWB
Monacid Red RS
Multicuer Red R
Navimill Red RS
Navitan Red RS
Pacid Red RS
Polar Red RS
Ratna Acid Red RS
Rifa Acid Fast Red RS
Rifa Leather Red R
Sandolan Red N-RS
Sandolan Red N-RSI
Sandolan Red RSNI
Sella Fast Red RS
Sulphonol Red R
Suminol Milling Red RS
Suminol Milling Red RS 125
Supranol Fast Red 3G
Supranol Fast Red GG
Supranol Red PBX-CF
Supranol Red R
Telon Fast Red GG
Tertracid Milling Red B
Triacid Fast Red RS
Vondamol Fast Red RS

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	HNBQFKZSMFFZQY-WDINFOTDSA-L
InChI2D string chemrof:inchi2d_string	InChI=1S/C37H30N4O10S3.2Na/c1-22-4-13-30(14-5-22)54(49,50)51-29-11-9-28(10-12-29)38-39-32-15-6-25(18-23(32)2)26-7-16-33(24(3)19-26)40-41-37-34(42)17-8-27-20-31(52(43,44)45)21-35(36(27)37)53(46,47)48;;/h4-21,42H,1-3H3,(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2
IUPAC name chemrof:IUPAC_name	1,3-Naphthalenedisulfonic acid, 8-[2-[3,3′-dimethyl-4′-[2-[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]diazenyl][1,1′-biphenyl]-4-yl]diazenyl]-7-hydroxy-, sodium salt (1:2)
Molecular formula chemrof:molecular_formula	C37H28N4Na2O10S3, C37H28N4O10S3.2Na
Molecular mass chemrof:molecular_mass	830.83
Monoisotopic mass chemrof:monoisotopic_mass	830.07629, 830.076295
SMILES string chemrof:smiles_string	Cc1ccc(S(=O)(=O)Oc2ccc(N=Nc3ccc(-c4ccc(N=Nc5c(O)ccc6cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c56)c(C)c4)cc3C)cc2)cc1.[Na+].[Na+]

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=6459-94-5	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82302	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.474.411	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID8021224	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1559341	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3188178	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/P8TW4PSS87	enrich_references.pubchem_identifier_url
KEGG	https://www.genome.jp/entry/C19209	enrich_references.chebi_xrefs
kegg.jp	https://www.kegg.jp/entry/C19209	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/22960	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q27155866	enrich_references.pubchem_identifier_url
wikidata.org	https://www.wikidata.org/wiki/Q27286379	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
1f31c0b1-6556-11dd-ad8b-0800200c9a66	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c92-0050c2490048	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
65d2003f-f884-4e42-b972-77d712e4a0d8	Environmental → Air → Indoor	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c91-0050c2490048	Environmental → Air → Long-term	EF 3.1	kg	0
4d9a8790-3ddd-11dd-8c93-0050c2490048	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c90-0050c2490048	Environmental → Air → Unknown	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9078-0050c2490048	Environmental → Ground → Agricultural	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c97-0050c2490048	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c8f-0050c2490048	Environmental → Ground → Unknown	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c95-0050c2490048	Environmental → Water → Long-term	EF 3.1	kg	0
4d9a8790-3ddd-11dd-8c98-0050c2490048	Environmental → Water → Ocean	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c94-0050c2490048	Environmental → Water → Surface water	EF 3.1	kg	2
4d9a8790-3ddd-11dd-8c96-0050c2490048	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (60 changes)

Open the changes page

Flow object JSON

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      "@value": "Apollo Nylon Fast Red R",
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      "@value": "Benzyl Fast Red BG",
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      "@value": "Benzyl Red BR",
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      "@value": "Best Acid Milling Red RS",
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      "@value": "C.I. Acid Red 114",
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      "@value": "Colomill Red RS",
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      "@value": "Concorde Acid Red M-RS",
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      "@value": "Concorde Leather Red RSN",
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    {
      "@value": "Covalene Red RS",
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      "@value": "Covalene Scarlet RS",
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    {
      "@value": "Covanyl Scarlet RS",
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    },
    {
      "@value": "Daedo Acid Red RS",
      "@language": "en",
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    },
    {
      "@value": "Dinacid Milling Red RG",
      "@language": "en",
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      }
    },
    {
      "@value": "Dycosweak Acid RS",
      "@language": "en",
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    },
    {
      "@value": "Eniacid Fast Red R",
      "@language": "en",
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    },
    {
      "@value": "Erionyl Red RS",
      "@language": "en",
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    },
    {
      "@value": "Erionyl Red RS 125",
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    {
      "@value": "Everacid Milling Red RS",
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    {
      "@value": "Everlan Red RS",
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C.I. Acid Red 114 (disodium Salt)

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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