2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine

C10H14O2S — CID 18716601

IUPAC2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
SMILESCc1sc(C)c2c1OC(C)C(C)O2
InChIInChI=1S/C10H14O2S/c1-5-6(2)12-10-8(4)13-7(3)9(10)11-5/h5-6H,1-4H3
InChIKeyXZBNLGYHRJYPNR-UHFFFAOYSA-N
MW198.29 g/mol
LogP2.91
Rot. Bonds

About 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine

2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine (PubChem CID 18716601) has the molecular formula C10H14O2S and a molecular weight of 198.29 g/mol. Its IUPAC name is 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine.

Molecular Properties

Compound Name2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
PubChem CID18716601
Molecular FormulaC10H14O2S
Molecular Weight198.29 g/mol
Exact Mass198.07
IUPAC Name2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
SMILESCc1sc(C)c2c1OC(C)C(C)O2
InChIInChI=1S/C10H14O2S/c1-5-6(2)12-10-8(4)13-7(3)9(10)11-5/h5-6H,1-4H3
InChIKeyXZBNLGYHRJYPNR-UHFFFAOYSA-N
XLogP2.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(Trifluoromethyl)-2,3-dihydrothieno[3,4-b][1,4]dioxine
CID 134969073
Thieno[3,4-b]-1,4-dioxin, 5-hexyl-2,3-dihydro-
CID 11020600
5,7-Dimethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
CID 18716605
5-Methyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
CID 23553881
(3,4-Dibutoxy-5-methylthiophen-2-yl)-trimethylsilane
CID 59664288
k01Prr15 1a
CID 101549569
5-Ethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
CID 68087843
3,3-Difluoro-6,8-dimethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepine
CID 130182524
(3-Fluoro-6,8-dimethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepin-3-yl)phosphane
CID 130182634
5,7-Dimethyl-3-(trifluoromethyl)-2,3-dihydrothieno[3,4-b][1,4]dioxine
CID 145344236
2,5-Dimethyl-3,4-bis(3,3,3-trifluoropropoxy)thiophene
CID 145344251
Tributyl-(7-dodecyl-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)stannane
CID 135078401

Frequently Asked Questions

What is the IUPAC name of 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
The IUPAC name of 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine (CID 18716601) is 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine.
What is the SMILES notation for 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
The canonical SMILES for 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine is Cc1sc(C)c2c1OC(C)C(C)O2.
What is the InChIKey of 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
The InChIKey is XZBNLGYHRJYPNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2S/c1-5-6(2)12-10-8(4)13-7(3)9(10)11-5/h5-6H,1-4H3.
What are the key properties of 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine?
2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine has a molecular weight of 198.29 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,7-tetramethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine is sourced from PubChem (CID 18716601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).