Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.37	5.53	-6.57	0	1	0	13	143.189	0	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.37	5.96	-28.94	1	1	1	14	144.197	0	↓ MOL2 SDF SMILES Flexibase

Note Type	Comments	Provided By
Boiling_Point	251-253?	Alfa-Aesar
Boiling_Point	251-253°	Alfa-Aesar
BP	257	TCI
BP [°C]	258	Acros Organics
Mp [°C]	35 - 37	Acros Organics
MP	38	TCI
purity	9.500000000000000e+001	Enamine Building Blocks Enamine Building Blocks
Purity	95%	Fluorochem
H phrase	H302: Harmful if swallowed	Acros Organics
H phrase	H302: Harmful if swallowed; H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation; H341: Suspected of causing genetic defects	Acros Organics
P phrase	P281: Use personal protective equipment as required	Acros Organics
P phrase	P281: Use personal protective equipment as required; P260: Do not breathe dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 +	Acros Organics
R phrase	R22: Harmful if swallowed.	Acros Organics
R phrase	R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin.; R68: Possible risks of irreversible effects.	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat	Acros Organics
Hazard	XN: Harmful	Acros Organics