Completing data — usually done within a minute
Basic information
- Standard SMILES
C=CCSC#N- InChIKey
IFVYHJRLWCUVBB-UHFFFAOYSA-N- Molecular formula
- C4H5NS
- Average molar mass
- 99.158 g/mol
- Monoisotopic mass
- 99.01427016
Names & identifiers
- Preferred name
- Prop-2-en-1-yl thiocyanate
- IUPAC
- Prop-2-en-1-yl thiocyanate
- English name
- allyl thiocyanate
- Molecular formula
- C4H5NS
- Molecular weight
- 99.15
Names & synonyms
allyl thiocyanateThiocyanic acid allyl3-Thiocyanato-1-propeneThiocyanic acid allyl esterThiocyanic acid, 2-propen-1-yl ester
Database identifiers
- CAS
764-49-8- PubChem CID
- 69816
- DTXSID
DTXSID00870765- ChEBI
CHEBI:183082- UNII
- CV25AS3FVT
- EC Number
- 212-126-5
- Nikkaji
- J1.730B
Properties
Physicochemical properties
- Boiling point
- 161 °C · 161°C
- Density
- 1.056 · 1.0560
- refractive index
- 1.5306 · 1.5306 (estimate)
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H312-H226-H335-H315-H302-H332
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- Hazard statements
- H319-H312-H226-H335-H315-H302-H332
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers5 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
南京大唐医药科技有限公司025-84341491 13951930983 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Additional notes
DefinitionChEBI: Allyl thiocyanate is a member of thiocyanates.
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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