2,3-Ditert-butylthiophene

HCID 34832
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Basic information

CAS
128788-04-5
Standard SMILES
CC(C)(C)c1ccsc1C(C)(C)C
InChIKey
UGSHDMAFOIOKNY-UHFFFAOYSA-N
Molecular formula
C12H20S
Average molar mass
196.35 g/mol
Monoisotopic mass
196.12857164

Names & identifiers

Preferred name
2,3-Ditert-butylthiophene
IUPAC
2,3-ditert-butylthiophene
English name
2,3-Ditert-butylthiophene
Molecular formula
C12H20S
Molecular weight
196.35

Names & synonyms

2,3-ditert-butylthiophene128788-04-5DTXSID70275107RefChem:245144DTXCID10202356di-t-butylthiophene2,3-di-tert-butylthiopheneSCHEMBL1106127UGSHDMAFOIOKNY-UHFFFAOYSA-NAKOS006331886Thiophene, 2,3-bis(1,1-dimethylethyl)-

Database identifiers

CAS
128788-04-5
PubChem CID
34832
DTXSID
DTXSID70275107
Nikkaji
J302.656F

Properties

Computed structural properties

XLogP
5
Topological polar surface area
28.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
13

Physicochemical properties

Boiling point
239.9 · 239.9±9.0 °C(Predicted)
Density
0.924 · 0.924±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers4 total

APAC Pharmaceutical, LLC[email protected]
HONEST JOY HOLDINGS LIMITED[email protected]
AlliChem, LLC[email protected]
CHEMPACIFIC[email protected]

Related reactions

2 records
New reaction record

Compound notes

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