(3-ethoxy-1,2-thiazol-5-yl)methanol

C6H9NO2S — CID 10241080

IUPAC(3-ethoxy-1,2-thiazol-5-yl)methanol
SMILESCCOc1cc(CO)sn1
InChIInChI=1S/C6H9NO2S/c1-2-9-6-3-5(4-8)10-7-6/h3,8H,2,4H2,1H3
InChIKeyMALBEVJIAXSSOC-UHFFFAOYSA-N
MW159.21 g/mol
LogP1.03
Rot. Bonds3

About (3-ethoxy-1,2-thiazol-5-yl)methanol

(3-ethoxy-1,2-thiazol-5-yl)methanol (PubChem CID 10241080) has the molecular formula C6H9NO2S and a molecular weight of 159.21 g/mol. Its IUPAC name is (3-ethoxy-1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(3-ethoxy-1,2-thiazol-5-yl)methanol
PubChem CID10241080
Molecular FormulaC6H9NO2S
Molecular Weight159.21 g/mol
Exact Mass159.04
IUPAC Name(3-ethoxy-1,2-thiazol-5-yl)methanol
SMILESCCOc1cc(CO)sn1
InChIInChI=1S/C6H9NO2S/c1-2-9-6-3-5(4-8)10-7-6/h3,8H,2,4H2,1H3
InChIKeyMALBEVJIAXSSOC-UHFFFAOYSA-N
XLogP1.03
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.21
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-Methoxy-1,2-thiazol-5-yl)methanol
CID 10630638
5-Methyl-3-(2,2,2-trifluoroethoxy)-1,2-thiazole
CID 90278794
3-(2,2-Difluoroethoxy)-5-methyl-1,2-thiazole
CID 168169609
5-Methyl-3-prop-2-ynoxy-1,2-thiazole
CID 118466346
3-Ethoxy-5-methyl-1,2-thiazole
CID 144044713
Ethane;3-methoxy-5-methyl-1,2-thiazole
CID 168169347
3-(2,2-Difluoroethoxy)-5-methyl-1,2-thiazole;ethane
CID 168169608
(3-Ethoxy-1,2-thiazol-5-yl)-ditritiomethanol
CID 10012228
Dideuterio-(3-ethoxy-1,2-thiazol-5-yl)methanol
CID 10419483
1-(3-Methoxy-1,2-thiazol-5-yl)ethanol
CID 126999944
3-(3-Methoxy-1,2-thiazol-5-yl)prop-2-yn-1-ol
CID 130647582
Sodium hydroxy(3-methoxy-1,2-thiazol-5-yl)methanesulfonate
CID 130856331

Frequently Asked Questions

What is the IUPAC name of (3-ethoxy-1,2-thiazol-5-yl)methanol?
The IUPAC name of (3-ethoxy-1,2-thiazol-5-yl)methanol (CID 10241080) is (3-ethoxy-1,2-thiazol-5-yl)methanol.
What is the SMILES notation for (3-ethoxy-1,2-thiazol-5-yl)methanol?
The canonical SMILES for (3-ethoxy-1,2-thiazol-5-yl)methanol is CCOc1cc(CO)sn1.
What is the InChIKey of (3-ethoxy-1,2-thiazol-5-yl)methanol?
The InChIKey is MALBEVJIAXSSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2S/c1-2-9-6-3-5(4-8)10-7-6/h3,8H,2,4H2,1H3.
What are the key properties of (3-ethoxy-1,2-thiazol-5-yl)methanol?
(3-ethoxy-1,2-thiazol-5-yl)methanol has a molecular weight of 159.21 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxy-1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 10241080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).