5-(2,4-Dichlorophenyl)-1,3,4-oxadiazol-2-amine
Basic information
- CAS
60160-13-6- Standard SMILES
Nc1nnc(-c2ccc(Cl)cc2Cl)o1- InChIKey
CFAKQLAZXZWZLX-UHFFFAOYSA-N- Molecular formula
- C8H5Cl2N3O
- Average molar mass
- 230.05 g/mol
- Monoisotopic mass
- 228.9809672
Names & identifiers
- Preferred name
- 5-(2,4-Dichlorophenyl)-1,3,4-oxadiazol-2-amine
- IUPAC
- 5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-amine
- English name
- 5-(2,4-Dichlorophenyl)-1,3,4-oxadiazol-2-amine
- Molecular formula
- C8H5Cl2N3O
- Molecular weight
- 230.05
Names & synonyms
5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-amine60160-13-6DTXSID00406487RefChem:529134DTXCID50357339MFCD000996171,3,4-Oxadiazol-2-amine, 5-(2,4-dichlorophenyl)-F2146-0617SCHEMBL26665241KCA16013EBC-73138AKOS000159982
Show more names
DB-358540EN300-118527F474287Z285233824
Database identifiers
- CAS
60160-13-6- PubChem CID
- 4778083
- DTXSID
DTXSID00406487- EC Number
- 109-974-2
- Nikkaji
- J3.406.822D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 207
Physicochemical properties
- form
- solid
- InChI
- 1S/C8H5Cl2N3O/c9-4-1-2-5(6(10)3-4)7-12-13-8(11)14-7/h1-3H,(H2,11,13)
- InChIKey
- CFAKQLAZXZWZLX-UHFFFAOYSA-N
- SMILES
- NC1=NN=C(C2=CC=C(Cl)C=C2Cl)O1
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 301 · P301+P310+P330
- WGK Germany
- 3 · WGK 3
- Storage Class
- 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- 3 Oral · Acute Tox. 3 Oral
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]
P264, P270, P301+P316, P321, P330, 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
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- wgk
- WGK 3
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301
- Hazard Classifications
- Acute Tox. 3 Oral
- Precautionary statements
- P301+P310+P330
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…