Basic information
- CAS
1207-69-8- Standard SMILES
Clc1c2ccccc2nc2ccccc12- InChIKey
BPXINCHFOLVVSG-UHFFFAOYSA-N- Molecular formula
- C13H8ClN
- Average molar mass
- 213.66 g/mol
- Monoisotopic mass
- 213.034527
Names & identifiers
- Preferred name
- 9-Chloroacridine
- IUPAC
- 9-chloroacridine
- English name
- 9-Chloroacridine
- Molecular formula
- C13H8ClN
- Molecular weight
- 213.66
Names & synonyms
9-Chloroacridine1207-69-8Acridine, 9-chloro-DTXSID4061622RefChem:107798DTXCID2033657214-895-29-chloro-acridineMFCD000222669-ChloracridinEINECS 214-895-2NSC 51950
Show more names
AURORA KA-43039-chloracridine9-chloroacridone9-Chloroacridine,95%9-CHLOROACRIDINE 95%9-Chloroacridine, GC 95%9-Chloroacridine/9-Chloroacridine
SCHEMBL455949AI3-52323CHEMBL2180144NSC51950NSC-51950AKOS001443923D70153BCP14588
Database identifiers
- CAS
1207-69-8- PubChem CID
- 71013
- DTXSID
DTXSID4061622- ChEMBL
CHEMBL2180144- EC Number
- 214-895-2
- Nikkaji
- J217.057D
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 209
Physicochemical properties
- Melting point
- 116 · 116-120 °C (lit.)
- Boiling point
- 346.74 °C · 346.74°C (rough estimate)
- Density
- 1.1961 · 1.1961 (rough estimate)
- refractive index
- 1.5868 · 1.5868 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- solid
- pka
- 3.96 · 3.96±0.10(Predicted)
- Appearance
- Light yellow to yellow Solid
- InChI
- InChI=1S/C13H8ClN/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H
- InChIKey
- BPXINCHFOLVVSG-UHFFFAOYSA-N
- SMILES
- C1C2C(=NC3C(C=2Cl)=CC=CC=3)C=CC=1
- CAS DataBase Reference
- 1207 · 1207-69-8(CAS DataBase Reference)
- NIST Chemistry Reference
- 9 · Acridine, 9-chloro-(1207-69-8)
- EPA Substance Registry System
- 9 · Acridine, 9-chloro- (1207-69-8)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi,Xn
- Risk Statements
- 36 · 36/37/38-22
- Safety Statements
- 26 · 26-36-37/39
- RIDADR
- 2811 · UN2811
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 29379000 · 29379000
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.6%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN2811
- hs_code
- 29379000
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- safety_code
- 26-36-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcridine, 9-chloro-: ACTIVE
Applications
Uses9-Chloroacridine was employed as chromogenic reagent in the spectrophotometric method for the quantitative determination of dapsone. It was also used in the synthesis of:series of novel chalcones bearing acridine moiety attached to the amino group in their ring Anew acridine derivatives9-phenoxyacridine and 4-phenoxyfuro[2,3-b]quinoline derivatives
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
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Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
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Related reactions
22 records
Compound notes
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