(2E)-3-(tert-butylsulfanyl)prop-2-enimidic acid

AlkaPlorer ID: AK319187

Synonym: None

IUPAC Name: (E)-3-tert-butylsulfanylprop-2-enamide

Structure

SMILES: CC(C)(C)S/C=C/C(=N)O

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InChI: InChI=1S/C7H13NOS/c1-7(2,3)10-5-4-6(8)9/h4-5H,1-3H3,(H2,8,9)/b5-4+

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InChIKey: UTURRRPPLDSNSU-SNAWJCMRSA-N

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Reference

PubChem CID: 6063118

CAS: 871-39-6

NPASS: NPC219530

Source

Properties Information

Molecule Weight: 159.254

TPSA: 44.08

MolLogP: 2.56707

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information