1,4-Dihydroxy-2-((3-methoxypropyl)amino)anthraquinone

HCID 88436CAS 20253-60-5
Substructure searchFind similar structures

Basic information

Standard SMILES
COCCCNc1cc(O)c2c(c1O)C(=O)c1ccccc1C2=O
InChIKey
DCFOEKQHOISDOS-UHFFFAOYSA-N
Molecular formula
C18H17NO5
Average molar mass
327.3 g/mol
Monoisotopic mass
327.11067264

Names & identifiers

Preferred name
1,4-Dihydroxy-2-((3-methoxypropyl)amino)anthraquinone
IUPAC
1,4-dihydroxy-2-(3-methoxypropylamino)anthracene-9,10-dione
English name
1,4-dihydroxy-2-[(3-methoxypropyl)amino]anthraquinone
Molecular formula
C18H17NO5
Molecular weight
327.33

Names & synonyms

1,4-Dihydroxy-2-((3-methoxypropyl)amino)anthraquinone20253-60-5EINECS 243-642-9SCHEMBL10597732DTXSID40174097NS000265602-(methoxypropylamino)-1,4-dihydroxyanthraquinone1,4-DIHYDROXY-2-[(3-METHOXYPROPYL)AMINO]ANTHRACENE-9,10-DIONE1,4-dihydroxy-2-[(3-methoxypropyl)amino]anthraquinone1,4-Dihydroxy-2-[(3-methoxypropyl)amino]-9,10-anthracenedione9,10-Anthracenedione, 1,4-dihydroxy-2-[(3-methoxypropyl)amino]-

Database identifiers

CAS
20253-60-5
PubChem CID
88436
DTXSID
DTXSID40174097
EC Number
243-642-9
Nikkaji
J280.498K

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
95.9 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
24

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

Related reactions

2 records
New reaction record

Linked notes

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