METHYL (4-HYDROXYMETHYL)BENZOATE Structure

METHYL (4-HYDROXYMETHYL)BENZOATE

Chemical Properties

Melting point 47-50 °C (lit.)
Boiling point 157 °C / 5mmHg
Density  1.1708 (rough estimate)
refractive index  1.5500 (estimate)
Flash point >230 °F
storage temp.  Sealed in dry,Room Temperature
solubility  chloroform: soluble25mg/mL, clear, colorless to faint yellow or tan
pka 13.99±0.10(Predicted)
form  Powder or Cyrstals
color  White
InChI 1S/C9H10O3/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5,10H,6H2,1H3
InChIKey VBWFYEFYHJRJER-UHFFFAOYSA-N
SMILES COC(=O)c1ccc(CO)cc1
CAS DataBase Reference 6908-41-4(CAS DataBase Reference)
EPA Substance Registry System Benzoic acid, 4-(hydroxymethyl)-, methyl ester (6908-41-4)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319
Precautionary statements P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  37/39-26
WGK Germany  3
TSCA  TSCA listed
HS Code  29181990
Storage Class 11 - Combustible Solids
NFPA 704:
1
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