Registration Dossier
Registration Dossier
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EC number: 915-600-6 | CAS number: 64553-79-3
Reference substances
- IUPAC name:
- 1-(butylamino)-4-[(2-ethylhexyl)amino]-9,10-dihydroanthracene-9,10-dione
Inventory
- EC number:
- 287-289-9
- EC name:
- 1-(butylamino)-4-[(2-ethylhexyl)amino]anthraquinone
- CAS number:
- 85455-53-4
- CAS number:
- 85455-53-4
Synonyms
- Names:
- 1-(Butylamino)-4-[(2-ethylhexyl)amino]-9,10-anthracenedione
- Identifier:
- IUPAC name
- 1-(butylamino)-4-[(2-ethylhexyl)amino]-9,10-anthraquinone
- Identifier:
- IUPAC name
- 1-(butylamino)-4-[(2-ethylhexyl)amino]-9,10-dihydroanthracene-9,10-dione
- Identifier:
- IUPAC name
- : 1-(butylamino)-4-[(2-ethylhexyl)amino]anthraquinone
- Identifier:
- other: SMILES notation
- CCCCC(CC)CNc1ccc(c2c1C(=O)c3ccccc3C2=O)NCCCC
- Identifier:
- other: SMILES notation
- CCCCNc1ccc(NCC(CC)CCCC)c2C(=O)c3ccccc3C(=O)c12
- Identifier:
- other: InChl
- InChI=1/C26H34N2O2/c1-4-7-11-18(6-3)17-28-22-15-14-21(27-16-8-5-2)23-24(22)26(30)20-13-10-9-12-19(20)25(23)29/h9-10,12-15,18,27-28H,4-8,11,16-17H2,1-3H3
- Identifier:
- other: InChl
- InChI=1S/C26H34N2O2/c1-4-7-11-18(6-3)17-28-22-15-14-21(27-16-8-5-2)23-24(22)26(30)20-13-10-9-12-19(20)25(23)29/h9-10,12-15,18,27-28H,4-8,11,16-17H2,1-3H3
Molecular and structural information
- Molecular formula:
- C26H34N2O2
- Molecular weight:
- 406.56
- SMILES notation:
- CCCCC(CC)CNc1ccc(c2c1C(=O)c3ccccc3C2=O)NCCCC
- InChl:
- InChI=1S/C26H34N2O2/c1-4-7-11-18(6-3)17-28-22-15-14-21(27-16-8-5-2)23-24(22)26(30)20-13-10-9-12-19(20)25(23)29/h9-10,12-15,18,27-28H,4-8,11,16-17H2,1-3H3
- Structural formula:
Related substances
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