Basic information
- CAS
6973-93-9- Standard SMILES
Nc1ccc2[nH]c(=O)c(=O)[nH]c2c1- InChIKey
DNCKPMPEGDANJK-UHFFFAOYSA-N- Molecular formula
- C8H7N3O2
- Average molar mass
- 177.16 g/mol
- Monoisotopic mass
- 177.05382648
Names & identifiers
- Preferred name
- 6-Aminoquinoxaline-2,3(1H,4H)-dione
- IUPAC
- 6-amino-1,4-dihydroquinoxaline-2,3-dione
- English name
- 2,3-Quinoxalinedione,6-amino-1,4-dihydro-(9CI)
- Molecular formula
- C8H7N3O2
- Molecular weight
- 177.16
Names & synonyms
6973-93-96-aminoquinoxaline-2,3(1H,4H)-dione6-amino-1,4-dihydroquinoxaline-2,3-dione6-Amino-2,3-dihydroxyquinoxalineQuinoxaline-6-amine, 2,3-dihydro-6-Amino-2,3-dihydroxychinoxalineNSC 48962BRN 01681462,3-Quinoxalinedione, 6-amino-1,4-dihydro-6MO9U2N25FNSC-489624-25-00-04192 (Beilstein Handbook Reference)
Show more names
2,3-Quinoxalinedione,6-amino-1,4-dihydro-(9CI)
UNII-6MO9U2N25FDTXSID902200336-AMINO-1,4-DIHYDRO-2,3-QUINOXALINEDIONERefChem:199065DTXCID90142524807-327-56-amino-1,2,3,4-tetrahydroquinoxaline-2,3-dione6-Amino-1,4-dihydro-quinoxaline-2,3-dione
Database identifiers
- CAS
6973-93-9- PubChem CID
- 96030
- DTXSID
DTXSID90220033- ChEMBL
CHEMBL4786118- UNII
- 6MO9U2N25F
- EC Number
- 807-327-5
- Nikkaji
- J2.050.984H
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 254
Physicochemical properties
- Melting point
- 300 °C · >300 °C(Solv: ethanol (64-17-5))
- Density
- 1.433 · 1.433±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 10.26 · 10.26±0.20(Predicted)
- Appearance
- Light yellow to green yellow Solid
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 6 MO9U2N25F · 6MO9U2N25F
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 317 · H317-H411
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-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
Warning
H317 (99%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 105 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (99%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H317-H411
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Chemistry & industry
Suppliers16 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
南京普笙生物医药科技有限公司02557628056 15150681880 · [email protected]
成都添福瑞生物科技有限公司18030648795 18030648795 · [email protected]
上海常丰生物医药科技有限公司+86-021-61727342 13611721451 · [email protected]
成都麦卡希化工有限公司028-85632863 18108198598 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
艾览（上海）化工科技有限公司400-668-9898 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海凯为化学科技有限公司
Related reactions
2 records
Compound notes
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