methyl (RS)-3-(1-cyclopropyl-prop-2-ynyloxy)-4,5-dimethoxy-benzoate

HCID 54377500

Basic information

Standard SMILES
C#CC(Oc1cc(C(=O)OC)cc(OC)c1OC)C1CC1
InChIKey
UXOJPKWHYOWIOX-UHFFFAOYSA-N
Molecular formula
C16H18O5
Average molar mass
290.31 g/mol

Names & identifiers

Preferred name
methyl (RS)-3-(1-cyclopropyl-prop-2-ynyloxy)-4,5-dimethoxy-benzoate
IUPAC
methyl 3-(1-cyclopropylprop-2-ynoxy)-4,5-dimethoxybenzoate

Names & synonyms

SCHEMBL5657658UXOJPKWHYOWIOX-UHFFFAOYSA-N3-(1-cyclopropyl-prop-2-ynyloxy)-4,5-dimethoxy-benzoic acid methyl ester192315-04-1DB-217564methyl (RS)-3-(1-cyclopropyl-prop-2-ynyloxy)-4,5-dimethoxy-benzoate

Database identifiers

PubChem CID
54377500

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
54 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
21

Related reactions

4 records

Compound notes

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