2,5-Di-tert-butylfuran

HCID 138352
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Basic information

CAS
4789-40-6
Standard SMILES
CC(C)(C)c1ccc(C(C)(C)C)o1
InChIKey
LHCFPVDATVVDLD-UHFFFAOYSA-N
Molecular formula
C12H20O
Average molar mass
180.29 g/mol
Monoisotopic mass
180.15141526

Names & identifiers

Preferred name
2,5-Di-tert-butylfuran
IUPAC
2,5-ditert-butylfuran
English name
2,5-Di(tert-butyl)furan
Molecular formula
C12H20O
Molecular weight
180.29

Names & synonyms

2,5-Di-tert-butylfuran4789-40-62,5-ditert-butylfuran2,5-Di(tert-butyl)furanFuran, 2,5-bis(1,1-dimethylethyl)-Furan, 2,5-di-tert-butyl-2,5-Di-t-butylfuran2,5-di-tert.butylfuran2,5-di-tert-butyl-furanSCHEMBL47577DTXSID90197312LHCFPVDATVVDLD-UHFFFAOYSA-N

Database identifiers

CAS
4789-40-6
PubChem CID
138352
DTXSID
DTXSID90197312
Nikkaji
J80.903I

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
13.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
13

Physicochemical properties

Boiling point
210.05 °C · 210.05°C
Density
0.837 · 0.8370
refractive index
1.4369 · 1.4369

Chemistry & industry

Suppliers1 total

上海书亚医药科技有限公司400-685-9117 · [email protected]

Related reactions

1 records
New reaction record

Compound notes

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