(R)-4-Isopropyloxazolidine-2-thione
Basic information
- CAS
1217463-35-8- Standard SMILES
CC(C)[C@@H]1COC(=S)N1- InChIKey
CIRDXQWBLPPFPN-YFKPBYRVSA-N- Molecular formula
- C6H11NOS
- Average molar mass
- 145.23 g/mol
- Monoisotopic mass
- 145.05613515
Names & identifiers
- Preferred name
- (R)-4-Isopropyloxazolidine-2-thione
- IUPAC
- (4R)-4-propan-2-yl-1,3-oxazolidine-2-thione
- English name
- (R)-4-Isopropyl-1,3-oxazolidine-2-thione
- Molecular formula
- C6H11NOS
- Molecular weight
- 145.22
Names & synonyms
1217463-35-8(R)-4-Isopropyloxazolidine-2-thione(R)-4-Isopropyl-2-oxazolidinethione(R)-4-Isopropyl-1,3-oxazolidine-2-thioneMFCD06658218(4R)-4-propan-2-yl-1,3-oxazolidine-2-thione2-Oxazolidinethione, 4-(1-methylethyl)-, (4R)-DTXSID10583374AKOS016843443CS-0093694(4R)-4-(Propan-2-yl)-1,3-oxazolidine-2-thione(4R)-4-prop
Show more names
(4R)-4-isopropyl-1,3-oxazolidine-2-thione(R)-4-ISOPROPYL-2-OXAZOLIDINETHIONE,MIN.98%(R)-4-Isopropyl-2-oxazolidinethione,99%e.e.(R)-4-Isopropyl-2-oxazolidinethione, min. 98%(R)-4-Isopropyl-2-oxazolidinethione - [K91160]
A907438BS-49689SY064767DB-336243E77933F605073
Database identifiers
- CAS
1217463-35-8- PubChem CID
- 16211136
- DTXSID
DTXSID10583374
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- Melting point
- 48 · 48-52 °C
- Boiling point
- 171.2 · 171.2±23.0 °C(Predicted)
- Density
- 1.11 · 1.11±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- Powder
- pka
- 13.73 · 13.73±0.40(Predicted)
- color
- white to light-yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
- Hazard Codes
- Xi
- WGK Germany
- 3 · 3
- F
- 10 · 10-23
- Hazard Note
- Irritant
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10-23
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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