Basic information
- CAS
485334-66-5- Standard SMILES
O=C(O)CSc1nnc(-c2ccccc2Cl)o1- InChIKey
JANFAVUKCBTPSH-UHFFFAOYSA-N- Molecular formula
- C10H7ClN2O3S
- Average molar mass
- 270.69 g/mol
- Monoisotopic mass
- 269.986591
Names & identifiers
- Preferred name
- 2-((5-(2-Chlorophenyl)-1,3,4-oxadiazol-2-yl)thio)acetic acid
- IUPAC
- 2-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetic acid
- English name
- [5-(2-Chloro-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-acetic acid
- Molecular formula
- C10H7ClN2O3S
- Molecular weight
- 270.69
Names & synonyms
485334-66-52-((5-(2-Chlorophenyl)-1,3,4-oxadiazol-2-yl)thio)acetic acid2-[[5-(2-Chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]acetic acidRefChem:249442[5-(2-Chloro-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-acetic acid2-{[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetic acid2-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetic acidDTXSID501183739MFCD02741505AKOS001055244SY137279EN300-05107
Show more names
AKOS TOT-0420Acetic acid, 2-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]-
G35033Z559035922-((5-(2-Chlorophenyl)-1,3,4-oxadiazol-2-yl)thio)aceticacid{[5-(2-CHLOROPHENYL)-1,3,4-OXADIAZOL-2-YL]SULFANYL}ACETIC ACID2-[5-(2-chlorophenyl)-[1,3,4]oxadiazole-2-ylsulfanyl] acetic acid
Database identifiers
- CAS
485334-66-5
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
韶远科技(上海)有限公司4000665055 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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