Basic information
- CAS
235-06-3- Standard SMILES
c1ccc2c(c1)ccc1nncn12- InChIKey
PIRYKGLQLCKQPG-UHFFFAOYSA-N- Molecular formula
- C10H7N3
- Average molar mass
- 169.18 g/mol
- Monoisotopic mass
- 169.06399724
Names & identifiers
- Preferred name
- s-Triazolo[4,3-a]quinoline
- IUPAC
- [1,2,4]triazolo[4,3-a]quinoline
- English name
- 1,2,4-Triazolo[4,3-a]quinoline
- Molecular formula
- C10H7N3
- Molecular weight
- 169.18
Names & synonyms
[1,2,4]Triazolo[4,3-a]quinoline235-06-32,3,9b-Triazabenz[e]indenes-Triazolo(4,3-a)quinolines-Triazolo[4,3-a]quinolineEINECS 205-943-3(1,2,4)Triazolo(4,3-a)quinolineAI3-52871Triazolo(4,3a)quinoline2,3,9b-Triazabenz[g]indeneDTXSID301780642,3,9b-Triazabenz(e)indene
Show more names
lithium hexadecanoateTRIAZOLO (4,3A) QUINOLINEs-Triazolo[4,3-a]quinoline,99%1,2,4-Triazolo[4,3-a]auinoline1,2,4-Triazolo[4,3-alpha]quinoline1,2,4-Triazolo4,3-aüquinoline, 99%
2,3,9b-Triazabenz(g)indeneRefChem:180726DTXCID60100555205-943-3InChI=1/C10H7N3/c1-2-4-9-8(3-1)5-6-10-12-11-7-13(9)10/h1-7PIRYKGLQLCKQPG-UHFFFAOYSA-N1,2,4-Triazolo[4,3-a]quinolineorb3030319
Database identifiers
- CAS
235-06-3- PubChem CID
- 67477
- DTXSID
DTXSID30178064- EC Number
- 205-943-3
- Nikkaji
- J149.869J
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 195
Physicochemical properties
- Melting point
- 175 · 175-177 °C
- Boiling point
- 288.47 °C · 288.47°C (rough estimate)
- Density
- 1.2396 · 1.2396 (rough estimate)
- refractive index
- 1.655 · 1.6550 (estimate)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- Safety Statements
- 24 · 24/25
- HS Code
- 29349990 · 29349990
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/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 39 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 Irrit. 2 (100%)
Safety data
- hs_code
- 29349990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers5 total
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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