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Chemical structure of Angelic acid

GC35343

Angelic acid

Also known as (Z)-2-methylbut-2-enoic acid

Angelic Acid is a substance found in the essential oil of Anthemis nobilis, and it exists in an ester form

ChemicalCAS565-63-9MW100.12FormulaC5H8O2
CAS number
565-63-9
Molecular weight
100.12
Formula
C5H8O2
Solubility
DMSO： 250 mg/mL (2497·00 mM)
InChIKey
UIERETOOQGIECD-ARJAWSKDSA-N
Catalogue number
GC35343
Brand
GLPBIO
Computed properties PubChem CID 643915 · XLogP 1 · TPSA 37.3 Ų · H-bond donors 1
XLogP
1
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
7

SMILES C/C=C(/C)\C(=O)O

Computed descriptors from PubChem (CID 643915), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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