(Ethoxymethylidene)propanedioic acid

HCID 14715768

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Basic information

CAS: 88172-36-5
Standard SMILES: CCOC=C(C(=O)O)C(=O)O
InChIKey: YIFCWYUSYGFFMH-UHFFFAOYSA-N
Molecular formula: C6H8O5
Average molar mass: 160.12 g/mol
Monoisotopic mass: 160.03717335

Names & identifiers

Preferred name: (Ethoxymethylidene)propanedioic acid
IUPAC: 2-(ethoxymethylidene)propanedioic acid

Names & synonyms

DTXSID30563294(Ethoxymethylidene)propanedioic acid88172-36-5RefChem:210479DTXCID40514070ethoxymethylenemalonic acid2-ethoxymethylenemalonic acidSCHEMBL1421463YIFCWYUSYGFFMH-UHFFFAOYSA-NAKOS006274661

Database identifiers

CAS: 88172-36-5
PubChem CID: 14715768
DTXSID: DTXSID30563294

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 83.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 4
Heavy atoms: 11
Formal charge: 0
Complexity: 177

Related reactions

1 records

New reaction record

HRID 1577857As reactantuspto-grants-1981_09

Compound notes

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