Basic information
- CAS
6943-87-9- Standard SMILES
CSCC(C)O- InChIKey
VHMYGROEIUZTQW-UHFFFAOYSA-N- Molecular formula
- C4H10OS
- Average molar mass
- 106.19 g/mol
- Monoisotopic mass
- 106.04523611
Names & identifiers
- Preferred name
- 2-Propanol, 1-(methylthio)-
- IUPAC
- 1-methylsulfanylpropan-2-ol
- English name
- 1-(methylthio)propan-2-ol
- Molecular formula
- C4H10OS
- Molecular weight
- 106.19
Names & synonyms
6943-87-92-Propanol, 1-(methylthio)-1-(Methylthio)-2-propanolEINECS 230-102-2NSC 51696DTXSID80884305RefChem:89164DTXCID308596841-(methylsulfanyl)propan-2-ol1-(Methylthio)propan-2-ol1-methylsulfanylpropan-2-olMFCD12779642
Show more names
1-(Methylsulfanyl)propan-2-ol - [M93798]
NSC516961-(methylthio) 2-propanolSCHEMBL2350785SCHEMBL5955458SCHEMBL6025402SCHEMBL9713519VHMYGROEIUZTQW-UHFFFAOYSA-NNSC-51696
Database identifiers
- CAS
6943-87-9- PubChem CID
- 97869
- DTXSID
DTXSID80884305- EC Number
- 230-102-2
- Nikkaji
- J265.979D
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 45.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 30.7
Physicochemical properties
- Boiling point
- 67 °C · 67 °C(Press: 20 Torr)
- Density
- 1.039 g/cm3 · 1.039 g/cm3
- storage temp.
- 2 · 2-8°C, protect from light, stored under nitrogen
- pka
- 14.43 · 14.43±0.20(Predicted)
- Appearance
- Colorless to light yellow Liquid
- EPA Substance Registry System
- 2 · 2-Propanol, 1-(methylthio)- (6943-87-9)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H332-H302-H335-H227-H315-H319
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P210-P280-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362
- TSCA
- TSCA listed
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
H227 (100%): Combustible liquid [Warning Flammable liquids]
P210, 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, P370+P378, P403, 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 CategoriesFlam. Liq. 4 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H312-H332-H302-H335-H227-H315-H319
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P210-P280-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Propanol, 1-(methylthio)-: INACTIVE
Suppliers6 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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