Basic information
- CAS
86-38-4- Standard SMILES
COc1ccc2nc3cc(Cl)ccc3c(Cl)c2c1- InChIKey
RYRNQWYNHLLOGX-UHFFFAOYSA-N- Molecular formula
- C14H9Cl2NO
- Average molar mass
- 278.1 g/mol
- Monoisotopic mass
- 277.0061193
Names & identifiers
- Preferred name
- 3,9-Dichloro-7-methoxyacridine
- IUPAC
- 6,9-dichloro-2-methoxyacridine
- English name
- 6,9-Dichloro-2-methoxyacridine
- Molecular formula
- C14H9Cl2NO
- Molecular weight
- 278.13
Names & synonyms
6,9-Dichloro-2-methoxyacridine3,9-Dichloro-7-methoxyacridineHalocrinHalocrineL7V65XW6XUNSC-2095NSC-2951EINECS 201-666-7DTXSID60235331NSC 2095NSC 2951RefChem:91934
Show more names
6,9-DICHLORO-2-METHOXLABOTEST-BB LT004552726,9-Dichloro-2-methoxyacriAcridine,6,9-dichloro-2-Methoxy-6,9-DICHLORO-2-METHOXYACRIDINE 99%6,9-Dichloroacridin-2-yl methyl ether, 6,9-Dichloro-2-methoxy-10-azaanthracene
DTXCID60157822201-666-7RYRNQWYNHLLOGX-UHFFFAOYSA-N86-38-42-Methoxy-6,9-dichloroacridineAcridine, 6,9-dichloro-2-methoxy-MFCD000050286,9-dichloro-2-methoxy-acridine
Database identifiers
- CAS
86-38-4- PubChem CID
- 66577
- DTXSID
DTXSID60235331- ChEMBL
CHEMBL4443373- UNII
- L7V65XW6XU
- EC Number
- 201-666-7
- Nikkaji
- J4.940I
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 302
Physicochemical properties
- Melting point
- 163 · 163-165 °C (lit.)
- Boiling point
- 444.3 · 444.3±25.0 °C(Predicted)
- Density
- 1.52 g/cm3 · 1.52 g/cm3
- storage temp.
- 2 · 2-8°C
- form
- solid
- pka
- 2.98 · 2.98±0.10(Predicted)
- Appearance
- Light yellow to yellow Powder
- Water Solubility
- Insoluble in water.
- BRN
- 226309 · 226309
- InChI
- 1S/C14H9Cl2NO/c1-18-9-3-5-12-11(7-9)14(16)10-4-2-8(15)6-13(10)17-12/h2-7H,1H3
- InChIKey
- RYRNQWYNHLLOGX-UHFFFAOYSA-N
- SMILES
- COc1ccc2nc3cc(Cl)ccc3c(Cl)c2c1
- CAS DataBase Reference
- 86 · 86-38-4(CAS DataBase Reference)
- FDA UNII
- 7 V65XW6XU · L7V65XW6XU
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P233, P260, P261, P264, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Faceshields, Gloves
- wgk
- 3
- hs_code
- 2933998090
- risk_code
- 36/37/38-42/43
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS08
- hazard_code
- Xn
- safety_code
- 26-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H317-H319-H334-H335
- Hazard Classifications
- Eye Irrit. 2Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
- Precautionary statements
- P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses6,9-Dichloro-2-methoxyacridine is used to prepare 6-chloro-2-methoxy-acridin-9-ylamine by reacting with phenol and ammonium carbonate. It is used in the preparation of 9-amino-6-chloro-2-methoxyacridine, N'-(6-Chloro-2-methoxy-acridin-9-yl)-heptylamine and N,N'-bis-(6-chloro-2-methoxy-acridin-9-yl)-hexane-1,6-diamine. Further, it is involved in the preparation of 4-aminoquinoline and 9-aminoacridine derivatives by reaction with quinolizidinylalkylamines.
General Description6,9-Dichloro-2-methoxyacridine on reaction with quinolizidinylalkylamines yields 4-aminoquinoline and 9-aminoacridine derivatives.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers95 total
韶远科技(上海)有限公司4000665055 · [email protected]
北京诺德恒信化工技术有限公司010-84929330 13811281791 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Related reactions
25 records
Compound notes
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