Basic information
- CAS
17348-59-3- Standard SMILES
CC(C)OC(C)(C)C- InChIKey
HNFSPSWQNZVCTB-UHFFFAOYSA-N- Molecular formula
- C7H16O
- Average molar mass
- 116.2 g/mol
- Monoisotopic mass
- 116.12011513
Names & identifiers
- Preferred name
- Propane, 2-methyl-2-(1-methylethoxy)-
- IUPAC
- 2-methyl-2-propan-2-yloxypropane
- English name
- 2-isopropoxy-2-methylpropane
- Molecular formula
- C7H16O
- Molecular weight
- 116.2
Names & synonyms
17348-59-3Propane, 2-methyl-2-(1-methylethoxy)-2-Methyl-2-(1-methylethoxy)propaneEINECS 241-373-1BRN 1731810Ether, tert-butyl isopropyl (6CI,7CI,8CI)RefChem:868847tert-Butyl isopropyl ether2-Isopropoxy-2-methylpropane2-methyl-2-propan-2-yloxypropaneEther, tert-butyl isopropylt-butyl isopropyl ether
Show more names
241-373-1
MFCD01697698isopropyl tertiary butyl ether(i-C3H7)O(t-C4H9)Propane,2-methyl-2-(1-methylethoxy)-SCHEMBL105383SCHEMBL127057SCHEMBL234653SCHEMBL441362
Database identifiers
- CAS
17348-59-3- PubChem CID
- 28488
- DTXSID
DTXSID4051792- EC Number
- 241-373-1
- Nikkaji
- J125.222D
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 59.3
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
LogP2.14
Physicochemical properties
- Melting point
- -95.35 °C · -95.35°C
- Boiling point
- 87.65 °C · 87.65°C
- Density
- 0.75 · 0.7500
- refractive index
- 1.3891 · 1.3891 (estimate)
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
- form
- Oil
- color
- Colourless
- Water Solubility
- 0.5 g/L · 0.5g/L(25 ºC)
- Henry's Law Constant
- 6.6 · 6.6×10-4 mol/(m3Pa) at 25℃, Yaws (1999)
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 2 · Propane, 2-methyl-2-(1-methylethoxy)- (17348-59-3)
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropane, 2-methyl-2-(1-methylethoxy)-: INACTIVE
Applications
UsesOne of the alkyl ethers with tert-Bu groups in their molecules which showed very poor biodegradability, tert-Bu Me ether (MTBE) [1634-04-4] had no effect on the biodegradability of gasoline blended with it. Studies on the biodegradation of several alkyl ethers were carried out by measuring the O uptake rate in the presence of standard activated sludge as a source of microorganisms.
Suppliers41 total
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
Related reactions
1 records
Compound notes
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