Ethyl 2-[(cyclopropyloxy)imino]-3-oxobutanoate

HCID 54259708

Notes Reactions

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Basic information

CAS: 106415-98-9
Standard SMILES: CCOC(=O)C(=NOC1CC1)C(C)=O
InChIKey: RCPUMMKIPCNXPA-UHFFFAOYSA-N
Molecular formula: C9H13NO4
Average molar mass: 199.2 g/mol
Monoisotopic mass: 199.0844579

Names & identifiers

Preferred name: Ethyl 2-[(cyclopropyloxy)imino]-3-oxobutanoate
IUPAC: ethyl 2-cyclopropyloxyimino-3-oxobutanoate

Names & synonyms

106415-98-9Ethyl 2-[(cyclopropyloxy)imino]-3-oxobutanoateSCHEMBL9703474DTXSID90710106RCPUMMKIPCNXPA-UHFFFAOYSA-Nethyl 2-cyclopropyloxyimino-3-oxobutyrate

Database identifiers

CAS: 106415-98-9
PubChem CID: 54259708
DTXSID: DTXSID90710106

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 65 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 6
Heavy atoms: 14
Formal charge: 0
Complexity: 268

Related reactions

7 records

New reaction record

HRID 124674As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 1074333As productuspto-grants-1990_11

HRID 1074334As reactantuspto-grants-1990_11

HRID 1074338As reactantuspto-grants-1990_11

HRID 1723575As productuspto-grants-1989_08

HRID 1723576As reactantuspto-grants-1989_08

HRID 1723580As reactantuspto-grants-1989_08

Compound notes

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