2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate

Benzoic acid, 3,3′-[(2,5-dimethyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)-2,1-diazenediyl]]bis[4-methyl-, 1,1′-bis(2-chloroethyl) ester
Benzoic acid, 3,3′-[(2,5-dimethyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)azo]]bis[4-methyl-, bis(2-chloroethyl) ester
C.I. Pigment Red 220
Cromophtal Red D 3830
Cromophtal Red G
Cromophtal Red K 3830
DTXSIDO0887313
Pigment Red 220
Red K 3830

Property	Value
InChI2D key string chemrof:inchi2d_key_string	VISHVOOFNOAMFD-UHFFFAOYSA-N, XTBJBXBNPQDSCC-JRDITHOPSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C50H42Cl2N6O8/c1-27-16-17-33(49(63)65-20-18-51)26-41(27)55-57-43-34-13-7-5-11-31(34)24-37(45(43)59)47(61)53-39-22-30(4)40(23-29(39)3)54-48(62)38-25-32-12-6-8-14-35(32)44(46(38)60)58-56-42-28(2)10-9-15-36(42)50(64)66-21-19-52/h5-17,22-26,55-56H,18-21H2,1-4H3,(H,53,61)(H,54,62)/b57-43+,58-44-
Isomeric SMILES string chemrof:isomeric_smiles_string	Cc1ccc(C(=O)OCCCl)cc1N/N=C1/C(=O)C(C(=O)Nc2cc(C)c(NC(=O)C3=Cc4ccccc4/C(=N/Nc4c(C)cccc4C(=O)OCCCl)C3=O)cc2C)=Cc2ccccc21
IUPAC name chemrof:IUPAC_name	2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate
Molecular formula chemrof:molecular_formula	C50H42Cl2N6O8
SMILES string chemrof:smiles_string	Cc1ccc(C(=O)OCCCl)cc1NN=C1C(=O)C(C(=O)Nc2cc(C)c(NC(=O)C3=Cc4ccccc4C(=NNc4c(C)cccc4C(=O)OCCCl)C3=O)cc2C)=Cc2ccccc21

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=68259-05-2	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID00887313	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J289.106I	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/135853568	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q82866426	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
aa085635-e4a8-4de5-8b23-cee517270f5e	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
e50c187d-7473-491e-936b-cfd0a47d1500	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
fae07025-3a5e-4525-8f2b-87ac06417235	Environmental → Air → Indoor	EF 3.1	kg	4
1f3e1643-99e8-4624-9fdf-9070250b490a	Environmental → Air → Long-term	EF 3.1	kg	0
841c8c68-aa1b-4daf-b4d3-ab323f37d337	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
1f489054-3e68-4545-b44c-2e0f8282d0dc	Environmental → Air → Unknown	EF 3.1	kg	4
98945ad4-0c10-487a-bfba-e2a54ef352cd	Environmental → Ground → Agricultural	EF 3.1	kg	4
036a733d-5572-4a5d-bd75-34aa92bb5f1d	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
8587f5cd-6934-43ca-b5a9-ffe795dd126c	Environmental → Ground → Unknown	EF 3.1	kg	4
662704d9-d052-406a-bcd2-772d0045f613	Environmental → Water → Long-term	EF 3.1	kg	0
8733cddf-5f90-42eb-9195-2e004b54bd01	Environmental → Water → Ocean	EF 3.1	kg	4
8cf9dcec-9139-457d-9ff0-b1aa60c5f503	Environmental → Water → Surface water	EF 3.1	kg	4
ee41765e-c11d-4e27-86f7-a7f8de7050e6	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

{
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      "@value": "2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate",
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    {
      "@value": "C.I. Pigment Red 220",
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      "@value": "Cromophtal Red D 3830",
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2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

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