Basic information
- CAS
6007-23-4- Standard SMILES
CCC1SCCCS1- InChIKey
MMCSAFCIQDJGDY-UHFFFAOYSA-N- Molecular formula
- C6H12S2
- Average molar mass
- 148.3 g/mol
- Monoisotopic mass
- 148.03804238
Names & identifiers
- Preferred name
- 2-Ethyl-1,3-dithiane
- IUPAC
- 2-ethyl-1,3-dithiane
- English name
- 2-ETHYL-1,3-DITHIANE, 97+%
- Molecular formula
- C6H12S2
- Molecular weight
- 148.29
Names & synonyms
2-ethyl-1,3-dithiane6007-23-41,3-dithiane, 2-ethyl-DTXSID80334779RefChem:471709DTXCID30285868805-425-2InChI=1/C6H12S2/c1-2-6-7-4-3-5-8-6/h6H,2-5H2,1H1,3-Dithiane, 2-ethyl2-Ethyl[1,3]dithiane2-Ethyl-1,3,-dithianSCHEMBL2826754
Show more names
2-ETHYL-1,3-DITHIANE, 97+%
SCHEMBL6187109SCHEMBL8332706MFCD12910519AKOS025396806DB-251478
Database identifiers
- CAS
6007-23-4- PubChem CID
- 521915
- DTXSID
DTXSID80334779- EC Number
- 805-425-2
- Nikkaji
- J1.088.603A
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 57.5
Physicochemical properties
- Boiling point
- 116 °C/22mmHg · 116°C/22mmHg
- Flash point
- 87 ° · 87°
- CAS DataBase Reference
- 6007 · 6007-23-4
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- HS Code
- 29349990 · 29349990
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]
P264, P270, P301+P317, P330, 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
- hs_code
- 29349990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers4 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
3 records
Compound notes
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