lithium;hydride;thiophen-3-yl acetate

C6H7LiO2S — CID 175236484

IUPAClithium;hydride;thiophen-3-yl acetate
SMILESCC(=O)Oc1ccsc1.[H-].[Li+]
InChIInChI=1S/C6H6O2S.Li.H/c1-5(7)8-6-2-3-9-4-6;;/h2-4H,1H3;;/q;+1;-1
InChIKeyQLXYVOXIZXJUIB-UHFFFAOYSA-N
MW150.13 g/mol
LogP-1.21
Rot. Bonds1

About lithium;hydride;thiophen-3-yl acetate

lithium;hydride;thiophen-3-yl acetate (PubChem CID 175236484) has the molecular formula C6H7LiO2S and a molecular weight of 150.13 g/mol. Its IUPAC name is lithium;hydride;thiophen-3-yl acetate.

Molecular Properties

Compound Namelithium;hydride;thiophen-3-yl acetate
PubChem CID175236484
Molecular FormulaC6H7LiO2S
Molecular Weight150.13 g/mol
Exact Mass150.03
IUPAC Namelithium;hydride;thiophen-3-yl acetate
SMILESCC(=O)Oc1ccsc1.[H-].[Li+]
InChIInChI=1S/C6H6O2S.Li.H/c1-5(7)8-6-2-3-9-4-6;;/h2-4H,1H3;;/q;+1;-1
InChIKeyQLXYVOXIZXJUIB-UHFFFAOYSA-N
XLogP-1.21
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.13
LogP ≤ 5-1.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

lithium;hydride;phenyl acetate
CID 173276859
[4-[(R)-amino(thiophen-3-yl)methyl]phenyl] acetate;hydrochloride
CID 171229424
phenyl acetate;thiophene
CID 174909325
3-O-tert-butyl 1-O-thiophen-3-yl propanedioate
CID 159299934
thiophen-3-yl 4-fluorobenzoate
CID 70094612
thiophen-3-yl cyclopentanecarboxylate
CID 70344436
sodium;hydride;phenyl acetate
CID 159991718
thiophen-3-yl N-prop-2-enoylcarbamate
CID 59502696
phenyl acetate;hydroiodide
CID 172788123
methyl 2-chloro-2-thiophen-3-yloxyacetate
CID 57086770
(2,6-ditert-butyl-4-thiophen-3-ylphenyl) acetate
CID 102013088
(5-thiophen-3-yl-1,2-oxazol-3-yl) acetate
CID 174599806

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;thiophen-3-yl acetate?
The IUPAC name of lithium;hydride;thiophen-3-yl acetate (CID 175236484) is lithium;hydride;thiophen-3-yl acetate.
What is the SMILES notation for lithium;hydride;thiophen-3-yl acetate?
The canonical SMILES for lithium;hydride;thiophen-3-yl acetate is CC(=O)Oc1ccsc1.[H-].[Li+].
What is the InChIKey of lithium;hydride;thiophen-3-yl acetate?
The InChIKey is QLXYVOXIZXJUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O2S.Li.H/c1-5(7)8-6-2-3-9-4-6;;/h2-4H,1H3;;/q;+1;-1.
What are the key properties of lithium;hydride;thiophen-3-yl acetate?
lithium;hydride;thiophen-3-yl acetate has a molecular weight of 150.13 g/mol, XLogP of -1.21, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;thiophen-3-yl acetate is sourced from PubChem (CID 175236484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).