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Structure

Ethyl 3-hydroxy-4-methoxy-mandelate

CAS
91971-78-7
Catalog Number
ACM91971787
Category
Other Products
Molecular Weight
226.23
Molecular Formula
C11H14O5

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Specification

Synonyms
Isovanilmandelic acid-ethyl ester, Ethyl 3-hydroxy-4-methoxy-mandelate, 3-Hydroxy-4-methoxy-mandelic acid-ethyl ester, Ethyl hydroxy-(3-hydroxy-4-methoxy-phenyl)-acetate, 78814_FLUKA, AKOS011496537, FT-0669814, 3-Hydroxy-4-methoxy-mandelic Acid Ethyl Ester, |A,3-Dihydroxy-4-methoxy-benzeneacetic Acid Ethyl Ester, 91971-78-7
IUPAC Name
ethyl 2-hydroxy-2-(3-hydroxy-4-methoxyphenyl)acetate
Canonical SMILES
CCOC(=O)C(C1=CC(=C(C=C1)OC)O)O
InChI Key
TVPGKWGQPSIRLU-UHFFFAOYSA-N
Boiling Point
391.9ºC at 760 mmHg
Melting Point
124-130ºC
Flash Point
152.2ºC
Density
1.26g/cm³
Exact Mass
226.08400
Hazard Statements
Xn
H-Bond Acceptor
5
H-Bond Donor
2
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