CAS:96-47-9
2-Methyltetrahydrofuran
CAS No:
96-47-9Name:
2-MethyltetrahydrofuranMolecular Formula:
C5H10OMolecular Weight:
86.13
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2-Methyltetrahydrofuran ( CASNO:96-47-9 )
Identification and Related Records
- Name:
- 2-Methyltetrahydrofuran
- CAS Registry number:
- 96-47-9
- Synonyms:
- 2-Methyltetrahydrofuran, stabilized with 1% butylated hydroxytoluene
alpha-Methyltetrahydrofuran
tetrahydro-2-methylfuran
- EINECS(EC#):
- 202-507-4
- Molecular Formula:
- C5H10O
- Molecular Weight:
- 86.13
- Inchi:
- InChI=1/C5H10O/c1-5-3-2-4-6-5/h5H,2-4H2,1H3
- InChIKey:
- JWUJQDFVADABEY-UHFFFAOYSA-N
- Canonical SMILES:
- CC1CCCO1
Chemical and Physical Properties
- Appearance:
- Clear,colorless liquid
- Density:
- 0.86
- Melting Point:
- -136℃
- Boiling Point:
- 78-80℃
- Refractive Index:
- 1.4046-1.4066
- Flash Point:
- -11℃
- Water:
- 15 g/100 mL (25 C)
- Solubilities:
- 15 g/100 mL (25 C)
- Stability:
- Stable, but highly flammable. Incompatible with oxidizing agents, strong acids, strong bases. May form explosive peroxides in storage, so often supplied with an inhibitor added.
- HS Code:
- 29321900
- Storage temp:
- Flammables area
- Computed Properties:
- Molecular Weight:86.1323 [g/mol]
Molecular Formula:C5H10O
XLogP3-AA:1
H-Bond Donor:0
H-Bond Acceptor:1
Rotatable Bond Count:0
Exact Mass:86.073165
MonoIsotopic Mass:86.073165
Topological Polar Surface Area:9.2
Heavy Atom Count:6
Formal Charge:0
Complexity:43.2
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Ring Count:1
Effective Rotor Count:1
Conformer Sampling RMSD:0.4
CID Conformer Count:2
Safety and Handling
- Hazard Codes:
- F:Flammable
- Risk Statements:
- R11;R19;R36/37
- Safety Statements:
- S16;S26;S33;S39
- HazardClass:
- 3
- Safety:
- Safety Information of?2-Methyltetrahydrofuran (CAS No.96-47-9):
Hazard Codes:?
F,
Xi
Risk Statements:11-19-36/37
R11:Highly flammable.?
R19:May form explosive peroxides.?
R36/37:Irritating to eyes and respiratory system.
Safety Statements:16-23-39-33-26
S16:Keep away from sources of ignition.?
S23:Do not breathe vapour.?
S39:Wear eye / face protection.?
S33:Take precautionary measures against static discharges.?
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
RIDADR:UN 2536 3/PG 2
WGK Germany:2
RTECS:LU2800000
HazardClass:3
PackingGroup:II
HS Code:29321900
- PackingGroup:
- II
- Transport:
- UN 2536
- Specification:
- ?? 2-Methyltetrahydrofuran (CAS No.96-47-9), it also can be called Tetrahydro-2-methylfuran ; Furan, tetrahydro-2-methyl- ; 2-Methyl-4,5-Dihydrofuran ; 2-Methyloxolane ; alpha-Methyltetrahydrofuran . It is stable, but highly flammable. Incompatible with oxidizing agents, strong acids, strong bases. May form explosive peroxides in storage, so often supplied with an inhibitor added. Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Flammables-area.
- Report:
- Reported in EPA TSCA Inventory.
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