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Hydroxy(3-hydroxy-4-methoxyphenyl)acetic acid
[CAS# 97294-81-0]

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Identification
Name Hydroxy(3-hydroxy-4-methoxyphenyl)acetic acid
Synonyms 2-hydroxy-2-(3-hydroxy-4-methoxyphenyl)acetic acid; 3-Hydroxy-4-methoxymandelic acid
Molecular Structure CAS#: 97294-81-0, Hydroxy(3-hydroxy-4-methoxyphenyl)acetic acid
Molecular Formula C9H10O5
Molecular Weight 198.17
CAS Registry Number 97294-81-0
SMILES COc1ccc(cc1O)C(C(=O)O)O
InChI 1S/C9H10O5/c1-14-7-3-2-5(4-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)
InChIKey PXMUSCHKJYFZFD-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Boiling point 445.6±45.0°C at 760 mmHg (Cal.)
Flash point 184.3±22.2°C (Cal.)
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