Basic information
- CAS
30837-62-8- Standard SMILES
S=C1Nc2cccc3cccc(c23)N1- InChIKey
ZASDGLJUXIVFDL-UHFFFAOYSA-N- Molecular formula
- C11H8N2S
- Average molar mass
- 200.26 g/mol
- Monoisotopic mass
- 200.04081944
Names & identifiers
- Preferred name
- 1H-perimidine-2-thiol
- IUPAC
- 1,3-dihydroperimidine-2-thione
- English name
- 1H,3H-Perimidine-2-thione
- Molecular formula
- C11H8N2S
- Molecular weight
- 200.26
Names & synonyms
1H-Perimidine-2-thiolRefChem:438863849-777-51h,3h-perimidine-2-thione30837-62-81H-perimidine-2(3H)-thione1,3-dihydroperimidine-2-thionePerimidine-2(3H)-thione2,3-dihydro-1H-perimidine-2-thione2-mercaptoperimidinestarbld00444433-hydroperimidine-2-thione
Show more names
SCHEMBL4155254SCHEMBL15040701DTXSID90352348HMS1757I08FBA83762STK677170AKOS000518850AKOS001052932
Database identifiers
- CAS
30837-62-8- PubChem CID
- 723643
- DTXSID
DTXSID90352348- EC Number
- 849-777-5
- Nikkaji
- J631.597F
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 56.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H332-H312-H302-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
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, P317, 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
- H315-H319-H332-H312-H302-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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