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2785-98-0

Name 2,5-Dimethoxybenzoic acid
CAS 2785-98-0
EINECS(EC#) 220-503-0
Molecular Formula C9H10O4
MDL Number MFCD00002436
Molecular Weight 182.17
MOL File 2785-98-0.mol
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Chemical Properties

Appearance white fine crystalline powder
Melting point  76-78 °C (lit.)
Boiling point  275.56°C (rough estimate)
density  1.2481 (rough estimate)
refractive index  1.4500 (estimate)
storage temp.  Sealed in dry,Room Temperature
form  powder to crystal
pka 3.97±0.10(Predicted)
color  White to Almost white
BRN  2097993
InChI InChI=1S/C9H10O4/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey NYJBTJMNTNCTCP-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC(OC)=CC=C1OC
LogP 1.281 (est)
CAS DataBase Reference 2785-98-0(CAS DataBase Reference)
NIST Chemistry Reference Benzoic acid, 2,5-dimethoxy-(2785-98-0)

Safety Data

Hazard Codes  Xn,Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
Safety Statements 
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
S36:Wear suitable protective clothing .
WGK Germany  3
HS Code  29189900

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