methyl 2-(furan-2-yl)-2-methoxyacetate

C8H10O4 — CID 173192079

IUPACmethyl 2-(furan-2-yl)-2-methoxyacetate
SMILESCOC(=O)C(OC)c1ccco1
InChIInChI=1S/C8H10O4/c1-10-7(8(9)11-2)6-4-3-5-12-6/h3-5,7H,1-2H3
InChIKeyMGVIORZRKYMUAY-UHFFFAOYSA-N
MW170.16 g/mol
LogP1.14
Rot. Bonds3

About methyl 2-(furan-2-yl)-2-methoxyacetate

methyl 2-(furan-2-yl)-2-methoxyacetate (PubChem CID 173192079) has the molecular formula C8H10O4 and a molecular weight of 170.16 g/mol. Its IUPAC name is methyl 2-(furan-2-yl)-2-methoxyacetate.

Molecular Properties

Compound Namemethyl 2-(furan-2-yl)-2-methoxyacetate
PubChem CID173192079
Molecular FormulaC8H10O4
Molecular Weight170.16 g/mol
Exact Mass170.06
IUPAC Namemethyl 2-(furan-2-yl)-2-methoxyacetate
SMILESCOC(=O)C(OC)c1ccco1
InChIInChI=1S/C8H10O4/c1-10-7(8(9)11-2)6-4-3-5-12-6/h3-5,7H,1-2H3
InChIKeyMGVIORZRKYMUAY-UHFFFAOYSA-N
XLogP1.14
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.16
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

dimethyl 2-[1-(furan-2-yl)prop-2-enyl]propanedioate
CID 13217837
methyl (2S,3R)-3-(furan-2-yl)-3-hydroxy-2-phenylpropanoate
CID 638407
methyl N-[2-(furan-2-yl)-2-methoxyethyl]carbamate
CID 121145445
methyl 2-[[(1R)-1-(furan-2-yl)ethyl]amino]butanoate
CID 115353555
methyl (2S,3R)-3-(furan-2-yl)-2-methoxy-3-(2-methoxyanilino)propanoate
CID 10780893
methyl 2-[(S)-furan-2-yl(hydroxy)methyl]prop-2-enoate
CID 28595486
methyl (2S)-3-(furan-2-yl)-2-hydroxypropanoate
CID 15638338
(2R)-2-(furan-2-ylmethyl)-3-methoxy-3-oxopropanoic acid
CID 97184369
methyl (4R)-4-(furan-2-yl)-4-hydroxybut-2-ynoate
CID 102087738
methyl 4-(furan-2-yl)-4-hydroxy-2-oxobutanoate
CID 135218937
3-(furan-2-yl)pentane-2,4-dione
CID 12548240
methyl 2-(furan-2-yl)-2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate
CID 69345751

Frequently Asked Questions

What is the IUPAC name of methyl 2-(furan-2-yl)-2-methoxyacetate?
The IUPAC name of methyl 2-(furan-2-yl)-2-methoxyacetate (CID 173192079) is methyl 2-(furan-2-yl)-2-methoxyacetate.
What is the SMILES notation for methyl 2-(furan-2-yl)-2-methoxyacetate?
The canonical SMILES for methyl 2-(furan-2-yl)-2-methoxyacetate is COC(=O)C(OC)c1ccco1.
What is the InChIKey of methyl 2-(furan-2-yl)-2-methoxyacetate?
The InChIKey is MGVIORZRKYMUAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O4/c1-10-7(8(9)11-2)6-4-3-5-12-6/h3-5,7H,1-2H3.
What are the key properties of methyl 2-(furan-2-yl)-2-methoxyacetate?
methyl 2-(furan-2-yl)-2-methoxyacetate has a molecular weight of 170.16 g/mol, XLogP of 1.14, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(furan-2-yl)-2-methoxyacetate is sourced from PubChem (CID 173192079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).