Registration Dossier

General information

Inventory

EC number:
241-379-4
EC name:
1,4-bis(butylamino)anthraquinone
CAS number:
17354-14-2

No inventory information available

Reference substance information

IUPAC name:
1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-dione
Synonyms
Names:
9,10-Anthracenedione, 1,4-bis(butylamino)-
Identifier:
IUPAC name
1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-dione
Identifier:
IUPAC name
1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-dione
Identifier:
IUPAC name
1,4-bis(butylamino)anthraquinone
Identifier:
other: InChl
InChI=1/C22H26N2O2/c1-3-5-13-23-17-11-12-18(24-14-6-4-2)20-19(17)21(25)15-9-7-8-10-16(15)22(20)26/h7-12,23-24H,3-6,13-14H2,1-2H3
Identifier:
other: SMILES notation
O=C2c1ccccc1C(=O)c3c2c(ccc3NCCCC)NCCCC
1,4-bis(butylamino)-9,10-anthraquinone

CAS information

CAS number:
17354-14-2

Molecular and structural information

Molecular formula:
C22H26N2O2
Molecular weight:
350.454
SMILES notation:
CCCCNc1ccc(NCCCC)c2C(=O)c3ccccc3C(=O)c12
InChl:
InChI=1/C22H26N2O2/c1-3-5-13-23-17-11-12-18(24-14-6-4-2)20-19(17)21(25)15-9-7-8-10-16(15)22(20)26/h7-12,23-24H,3-6,13-14H2,1-2H3
Structural formula:
Chemical structure