3-Amino-3-cyclopropyl-acrylic acid ethyl ester (HCID 53401889)

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Basic information

Standard SMILES: CCOC(=O)C=C(N)C1CC1
InChIKey: SJAOFPHBAYOIAX-UHFFFAOYSA-N
Molecular formula: C8H13NO2
Average molar mass: 155.19 g/mol

Names & identifiers

Preferred name: 3-Amino-3-cyclopropyl-acrylic acid ethyl ester
IUPAC: ethyl 3-amino-3-cyclopropylprop-2-enoate

Names & synonyms

3-amino-3-cyclopropyl-acrylic acid ethyl esterSCHEMBL1549533SJAOFPHBAYOIAX-UHFFFAOYSA-NEthyl3-amino-3-cyclopropyl-acrylateEthyl 3-amino-3-cyclopropyl-acrylate

Database identifiers

PubChem CID: 53401889

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 52.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 11
Formal charge: 0
Complexity: 183

Related reactions

12 records

New reaction record

HRID 129939As productuspto-grants-1995_11

HRID 639611As productuspto-grants-2010_04

HRID 639612As reactantuspto-grants-2010_04

HRID 890500As reactantuspto-grants-2006_02

HRID 1073111As productuspto-grants-1990_11

HRID 1084894As productuspto-grants-1991_04

HRID 1242345As reactantuspto-grants-2006_10

HRID 1242529As reactantuspto-grants-2006_10

Compound notes

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