Basic information
- CAS
21840-08-4- Standard SMILES
Nc1nc(N)nc(Nc2ccc([As]=O)cc2)n1- InChIKey
YDKGKLBKFOIXPU-UHFFFAOYSA-N- Molecular formula
- C9H9AsN6O
- Average molar mass
- 292.13 g/mol
- Monoisotopic mass
- 292.005378
Overview
inhibits glutathione reductase
Names & identifiers
- Preferred name
- Melarsen oxide
- IUPAC
- 2-N-(4-arsorosophenyl)-1,3,5-triazine-2,4,6-triamine
- English name
- Melarsen Oxide
- Molecular formula
- C9H9AsN6O
- Molecular weight
- 292.13
Names & synonyms
Melarsen oxide21840-08-4MelarsenoxydMelox(P-ARSENOSOPHENYL)MELAMINE2XH88IXE7WN(sup 2)-(p-Arsenosophenyl)melamineNSC-34642Melamine, (p-arsenosophenyl)-DTXSID30176247N-(4-Arsenosophenyl)-1,3,5-triazine-2,4,6-triamine1,3,5-Triazine-2,4,6-triamine, N-(4-arsenosophenyl)-
Show more names
3177r.p.friedheim2065(p-Arsenosophenyl)melamminen(sup2)-(p-arsenosophenyl)melaminen(sup2)-(p-arsenosophenyl)-melamin5-triazine-2,4,6-triamine,n-(4-arsenosophenyl)-3
1,3,5-Triazine-2,4,6-triamine, N-(4-arsenosophenyl)-, dihydratemelarsenoxide2-(p-Arsenosoanilino)-4,6-diamino-s-triazinep-(4,6-diamino-1,3,5-triazin-2-yl)aminophenylarsonous acidRefChem:156310DTXCID8098738244-612-83177 R.P.
Database identifiers
- CAS
21840-08-4- PubChem CID
- 30830
- DTXSID
DTXSID30176247
Properties
Computed structural properties
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 250
Physicochemical properties
- solubility
- DMSO (Sparingly), Methanol (Slightly)
- form
- Solid
- color
- Off-White to Pale Brown
- REACH Annex XVII Substances List
- -1 · N-(p-arsenosophenyl)-1,3,5-triazine-2,4,6-triamine (21840-08-4)
- FDA UNII
- 2 XH88IXE7W · 2XH88IXE7W
- Symbol(GHS)
- 9 · GHS09,GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H410-H330
- Precautionary statements
- 260 · P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501-P273-P391-P501-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]
P260, P264, P270, P271, P273, P284, P301+P316, P304+P340, P316, P320, P321, P330, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory InformationRestricted substance: N-(p-arsenosophenyl)-1,3,5-triazine-2,4,6-triamine
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS09,GHS06
- Hazard statements
- H301-H410-H330
- Precautionary statements
- P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501-P273-P391-P501-P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Applications
UsesMelarsen Oxide is the active metabolite of Melarsoprol (M215100), the main drug used against late-stage sleeping sickness caused by Trypanosoma brucei subspecies.
Suppliers6 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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