Basic information
- CAS
6373-31-5- Standard SMILES
O=C1c2ccccc2C(=O)c2c1c(Cl)cc1c(=O)c3cc(Cl)cc(Cl)c3[nH]c21- InChIKey
SQAQTWYUQXFOMH-UHFFFAOYSA-N- Molecular formula
- C21H8Cl3NO3
- Average molar mass
- 428.6 g/mol
- Monoisotopic mass
- 426.95697616
Names & identifiers
- Preferred name
- Vat Violet 14
- IUPAC
- 6,10,12-trichloro-13H-naphtho[2,3-c]acridine-5,8,14-trione
- English name
- 6,10,12-trichloronaphth[2,3-c]acridine-5,8,14(13H)-trione
- Molecular formula
- C21H8Cl3NO3
- Molecular weight
- 428.65
Names & synonyms
6373-31-5Vat Violet 14C.I. Vat Violet 14Indanthrene Red Violet RRKPonsol Red Violet RRNXCaledon Red Violet 2RNPonsol Red Violet RRNXDBenzadone Red Violet 2RKIndanthren Red Violet RRKPalanthrene Red Violet RRKCarbanthrene Red Violet 2RNX6,10,12-Trichloronaphth[2,3-c]acridine-5,8,14(13H)-trione
Show more names
C.I.VATVIOLET14Vat Red Violet RRKIndanthrene Red Violet RRK.C.I.Vat Violet 14:C.I.67895
C.I. 67895EINECS 228-916-8NSC 47720DTXSID802131516,10,12-Trichloronaphth(2,3-c)acridine-5,8,14(13H)-trioneNaphth(2,3-c)acridine-5,8,14(13H)-trione, 6,10,12-trichloro-Naphth(2,3-c)acridan-5,8,14-trione, 6,10,12-trichloro-Naphtha(2,3-c)acridan-5,8,14-trione, 6,10,12-trichloro-
Database identifiers
- CAS
6373-31-5- PubChem CID
- 80763
- DTXSID
DTXSID80213151- UNII
- SLH4W9KK5C
- EC Number
- 228-916-8
- Nikkaji
- J206.976H
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 715
Physicochemical properties
- Henry's Law Constant
- 2.4 · 2.4×1010 mol/(m3Pa) at 25℃, Zhang et al. (2010)
Safety & regulation
Hazard information
Regulatory InformationHazard Traits - Bioaccumulation; Environmental Persistence
Chemistry & industry
Preparation methods
Preparation(a) 1-Chloroanthraquinone and 2-Aminobenzoic acid condensation in the presence of Nitrobenzene with Sulfuryl chloride and chloride Iodine monochloride and cyclization, (b) Naphtho[2,3-c]acridine-5,8,14(13H)-trionechloride, about three chlorine atoms introduced. Note: commodity contains some dichloride.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers3 total
Sunflower Export Import Pvt. Ltd.[email protected]
Portail Substances Chimiques[email protected]
宁波海曙唐彩化工有限公司86 0574 27862107 27862719
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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