Basic information
- CAS
4320-92-7- Standard SMILES
N#CCCn1ccnn1- InChIKey
MBRAVVAPGNQSAJ-UHFFFAOYSA-N- Molecular formula
- C5H6N4
- Average molar mass
- 122.13 g/mol
- Monoisotopic mass
- 122.05924621
Names & identifiers
- Preferred name
- 3-(1H-1,2,3-Triazol-1-yl)propanenitrile
- IUPAC
- 3-(triazol-1-yl)propanenitrile
- English name
- 3-(1H-1,2,3-Triazol-1-yl)propanenitrile
- Molecular formula
- C5H6N4
- Molecular weight
- 122.13
Names & synonyms
3-(1H-1,2,3-triazol-1-yl)propanenitrile4320-92-7DTXSID20574475RefChem:489721DTXCID40525247664-226-73-(triazol-1-yl)propanenitrileMFCD090405933-[1,2,3]Triazol-1-yl-propionitrileSCHEMBL3311774EAA32092AKOS022632990
Show more names
1H-1,2,3-Triazole-1-propanenitrile
CS-0215671EN300-27354F350544Z239085220
Database identifiers
- CAS
4320-92-7- PubChem CID
- 15568554
- DTXSID
DTXSID20574475- EC Number
- 664-226-7
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- 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 & 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 38 reports by companies from 1 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers1 total
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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