Basic information
- CAS
146-59-8- Standard SMILES
CCN(CCCl)CCCNc1c2ccc(Cl)cc2nc2ccc(OC)cc12.Cl.Cl- InChIKey
PWGOWIIEVDAYTC-UHFFFAOYSA-N- Molecular formula
- C21H25Cl2N3O.2ClH
- Average molar mass
- 479.3 g/mol
- Monoisotopic mass
- 477.090823
Overview
Icr 170 appears as yellow crystalline or chunky solid. (NTP, 1992)
Names & identifiers
- Preferred name
- Acridine mustard
- IUPAC
- N'-(2-chloroethyl)-N-(6-chloro-2-methoxyacridin-9-yl)-N'-ethylpropane-1,3-diamine;dihydrochloride
- English name
- 6-Chloro-9-[3-N-(2-chloroethyl)ethylamino]propylamino-2-methoxyacridine dihydrochloride
- Molecular formula
- C21H26Cl3N3O
- Molecular weight
- 442.81
Names & synonyms
Acridine mustardIcr-170ICR 1700I3A3407T2ICR-170HCHEBI:211836-Chloro-9-((3-((2-chloroethyl)ethylamino)propyl)amino)-2-methoxyacridine dihydrochlorideRefChem:109392205-675-7146-59-86-chloro-9-[3-n-(2-chloroethyl)ethylamino]propylamino-2-methoxyacridine dihydrochlorideN'-(2-chloroethyl)-N-(6-chloro-2-methoxyacridin-9-yl)-N'-ethylpropane-1,3-diamine;dihydrochloride
Show more names
icr170ACRIDINEICR170acridinemustardICR 170 ACRIDINE MUTAGEN*DIHYDROCHLORIDEacridine mutagen ICR 170 dihydrochloride4-[2-(4-butoxyphenyl)ethoxy]-8-fluoroquinoline6-Chloro-9-(3-[(2-chloroethyl)ethylamino]propylamino)-2-methoxyacridine6-chloro-9-(3-n-(2-chloroethyl)ethylamino]propylamino-2-methoxyacridine.2
N1-(6-Chloro-2-methoxyacridin-9-yl)-N3-(2-chloroethyl)-N3-ethylpropane-1,3-diamine dihydrochlorideCCRIS 1091EINECS 205-675-7UNII-0I3A3407T21,3-Propanediamine, N-(2-chloroethyl)-N'-(6-chloro-2-methoxy-9-acridinyl)-N-ethyl-, 2HCl6-Chloro-9-(3-(ethyl-2-chloroethyl)aminopropylamino)-2-methoxyacridine dihydrochloride9-(3-(Ethyl(2-chloroethyl)amino)propylamino)-6-chloro-2-methoxyacridine dihydrochlorideN-(2-chloroethyl)-N'-(6-chloro-2-methoxyacridin-9-yl)-N-ethylpropane-1,3-diamine dihydrochloride
Properties
Computed structural properties
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 442
Experimental & physicochemical properties
Chemical ClassesOther Uses -> Biochemical Research
Melting Point464 to 465 °F (decomposes) (NTP, 1992)
Physical Description
Icr 170 appears as yellow crystalline or chunky solid. (NTP, 1992)
Yellow solid; [CAMEO]
Physicochemical properties
- Melting point
- 231 · 231-232 °C
- storage temp.
- 2 · 2-8°C
- FDA UNII
- 0 I3A3407T2 · 0I3A3407T2
- EPA Substance Registry System
- Acridine mustard (146-59-8)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 331 · H331-H335-H319-H311-H315-H301
- Precautionary statements
- 261 · P261-P271-P304+P340-P311-P321-P403+P233-P405-P501-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P361-P363-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P310-P321-P330-P405-P501
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
DOT LabelPoison
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Health HazardsExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Hazards Summary
Intravenous LDLo (mouse) = 5 mg/kg; [RTECS] An irritant; Harmful by ingestion, inhalation, and skin absorption; Risk of irreversible adverse health effects; Possible carcinogen; [Acros Organics MSDS] See Acridine and Acridine orange. See Nitrogen mustard (HN-2).
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity ProfileICR 170 reacts as as a weak acid.
Air and Water ReactionsMay be sensitive to air. (NTP, 1992)
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Chemical agents that increase the rate of genetic mutation by interfering with the function of nucleic acids. A clastogen is a specific mutagen that causes breaks in chromosomes.
A class of drugs that differs from other alkylating agents used clinically in that they are monofunctional and thus unable to cross-link cellular macromolecules. Among their common properties are a requirement for metabolic activation to intermediates with antitumor efficacy and the presence in their chemical structures of N-methyl groups, that after metabolism, can covalently modify cellular DNA. The precise mechanisms by which each of these drugs acts to kill tumor cells are not completely understood. (From AMA, Drug Evaluations Annual, 1994, p2026)
Applications
General DescriptionYellow crystalline or chunky solid.
Suppliers2 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Additional notes
DefinitionChEBI: ICR-170 is a member of acridines. It has a role as an intercalator. It contains a N-(2-chloroethyl)-N'-(6-chloro-2-methoxyacridin-9-yl)-N-ethylpropane-1,3-diamine.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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