C.I. Mordant blue 14
Properties
- Molecular formula
- C17H18ClN3O4
- Molar mass
- 363.80 g/mol
- Exact mass
- 363.0986 Da
- logP
- 2.63Crippen estimate
- Polar surface area
- 114.8 Ų
- H-bond donors / acceptors
- 3 / 6
- Rotatable bonds
- 4
Identifiers
CAS number
1562-90-9SMILES
CCN(CC)c1ccc2nc3c(C(=N)[O-])cc(O)c(O)c3[o+]c2c1.ClInChIKey
VXAFJUDTZSMEFN-UHFFFAOYSA-NInChI
InChI=1S/C17H17N3O4.ClH/c1-3-20(4-2)9-5-6-11-13(7-9)24-16-14(19-11)10(17(18)23)8-12(21)15(16)22;/h5-8H,3-4H2,1-2H3,(H3-,18,19,21,22,23);1HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
11 names
- Phenoxazin-5-ium, 1-(aminocarbonyl)-7-(diethylamino)-3,4-dihydroxy-, chloride
- Phenoxazin-5-ium, 1-(aminocarbonyl)-7-(diethylamino)-3,4-dihydroxy-, chloride (1:1)
- C.I. 51050
- Celestin blue
- Celestine blue B
- Coreine blue B
- Coreine RR no. 65
- Gallo sky blue B
- Gallo sky blue S
- Celestine blue
- Celestin blue B
Work with C.I. Mordant blue 14
Similar compounds
Phenoxazin-5-ium, 3,7-bis(diethylamino)-, nitrate (1:1)73570-52-244 % similar
Rhodamine B81-88-938 % similar
4-(Diethylamino)-2-hydroxybenzaldehyde17754-90-433 % similar
2-[4-(Diethylamino)-2-hydroxybenzoyl]benzoic acid5809-23-432 % similar
Methylene violet 3rax4569-86-230 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds