2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol

C10H8O2S — CID 14958807

IUPAC2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol
SMILESOC1COc2c1sc1ccccc21
InChIInChI=1S/C10H8O2S/c11-7-5-12-9-6-3-1-2-4-8(6)13-10(7)9/h1-4,7,11H,5H2
InChIKeyZNWBWVUNSDNRJA-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.33
Rot. Bonds

About 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol

2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol (PubChem CID 14958807) has the molecular formula C10H8O2S and a molecular weight of 192.24 g/mol. Its IUPAC name is 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol.

Molecular Properties

Compound Name2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol
PubChem CID14958807
Molecular FormulaC10H8O2S
Molecular Weight192.24 g/mol
Exact Mass192.02
IUPAC Name2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol
SMILESOC1COc2c1sc1ccccc21
InChIInChI=1S/C10H8O2S/c11-7-5-12-9-6-3-1-2-4-8(6)13-10(7)9/h1-4,7,11H,5H2
InChIKeyZNWBWVUNSDNRJA-UHFFFAOYSA-N
XLogP2.33
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1]benzothiolo[3,2-b]furan-3-one
CID 14958806
dibenzothiophene;methane
CID 162233710
3-hydroxy-5-methyl-2,3-dihydrofuro[3,2-c]quinolin-4-one
CID 15329366
5-chloro-1,2,4,5-tetrahydro-[1]benzothiolo[2,3-d]oxepine
CID 114287059
2-cyclopropyl-3-iodo-1-benzothiophene
CID 151628210
bis(dibenzothiophene);ethane
CID 143921746
(3S,4R)-4-[(3-bromo-1-benzothiophen-2-yl)methylamino]oxolan-3-ol
CID 146143063
(1Z,10Z,19Z,28Z)-9,12,27,30-tetrathianonacyclo[27.7.0.02,10.03,8.011,19.013,18.020,28.021,26.031,36]hexatriaconta-1,3,5,7,10,13,15,17,19,21,23,25,28,31,33,35-hexadecaene
CID 15554848
dibenzothiophene;formaldehyde
CID 20556925
2-phenyl-3-[(2-phenyl-1-benzothiophen-3-yl)sulfonyl]-1-benzothiophene
CID 170560290
3-bromo-1-benzothiophene-2-thiol
CID 130235749
(5S)-2,3,4,5-tetrahydrobenzo[i][1]benzoxepin-5-ol
CID 79014244

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol?
The IUPAC name of 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol (CID 14958807) is 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol.
What is the SMILES notation for 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol?
The canonical SMILES for 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol is OC1COc2c1sc1ccccc21.
What is the InChIKey of 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol?
The InChIKey is ZNWBWVUNSDNRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O2S/c11-7-5-12-9-6-3-1-2-4-8(6)13-10(7)9/h1-4,7,11H,5H2.
What are the key properties of 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol?
2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol has a molecular weight of 192.24 g/mol, XLogP of 2.33, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-[1]benzothiolo[3,2-b]furan-3-ol is sourced from PubChem (CID 14958807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).