2-(3-Methoxy-allylidene)-malonic acid dimethyl ester

HCID 597992
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Basic information

Standard SMILES
COC=CC=C(C(=O)OC)C(=O)OC
InChIKey
NOBNTZJTOBIOHL-UHFFFAOYSA-N
Molecular formula
C9H12O5
Average molar mass
200.19 g/mol

Names & identifiers

Preferred name
2-(3-Methoxy-allylidene)-malonic acid dimethyl ester
IUPAC
dimethyl 2-(3-methoxyprop-2-enylidene)propanedioate

Names & synonyms

2-(3-methoxy-allylidene)-malonic acid dimethyl esterSCHEMBL113525NOBNTZJTOBIOHL-UHFFFAOYSA-NDB-087078dimethyl 2-(3-methoxyprop-2-enylidene)propanedioate

Database identifiers

PubChem CID
597992

Properties

Computed structural properties

XLogP
1
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
14

Related reactions

8 records
New reaction record

Compound notes

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