2-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid Structure

2-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid

Chemical Properties

Melting point 125 °C
Boiling point 387.7±30.0 °C(Predicted)
Density  1.14±0.1 g/cm3(Predicted)
pka 2.90±0.36(Predicted)
form  solid
InChI 1S/C13H13NO2/c1-9-7-8-10(2)14(9)12-6-4-3-5-11(12)13(15)16/h3-8H,1-2H3,(H,15,16)
InChIKey ZLYUUANOICYAAL-UHFFFAOYSA-N
SMILES Cc1ccc(C)n1-c2ccccc2C(O)=O
UNSPSC Code 12352106

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P271-P280
Hazard Codes  Xi
Risk Statements  36
Safety Statements  26
WGK Germany  WGK 3
Hazard Note  Harmful
HS Code  2933998090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
NFPA 704:
1
2 0

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