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)	-0.11	0.74	-46.75	3	2	1	41	109.152	1	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-0.11	0.34	-3.97	2	2	0	39	108.144	1	↓ MOL2 SDF SMILES Flexibase

Note Type	Comments	Provided By
Mp [°C]	21	Acros Organics
Melting_Point	21?	Alfa-Aesar
Melting_Point	21°	Alfa-Aesar
Boiling_Point	226?	Alfa-Aesar
Boiling_Point	226°	Alfa-Aesar
BP [°C]	73 - 74 (p=1 torr)	Acros Organics
BP	74 / 1	TCI
BP	74°/1mm	Oakwood Chemical
Purity	95%	Fluorochem
Hazard	C: Corrosive	Acros Organics
H phrase	H302: Harmful if swallowed; H312: Harmful in contact with skin; H314: Causes severe skin burns and eye damage	Acros Organics
H phrase	H318: Causes serious eye damage	Acros Organics
Warnings	IRRITANT	Matrix Scientific
P phrase	P280: Wear protective gloves/protective clothing/eye protection/face protection	Acros Organics
P phrase	P280: Wear protective gloves/protective clothing/eye protection/face protection; P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P305 + P351 + P338: IF IN EYES: Rinse caut	Acros Organics
R phrase	R21/22: Harmful in contact with skin and if swallowed.	Acros Organics
R phrase	R21/22: Harmful in contact with skin and if swallowed.; R34: Causes burns.	Acros Organics
Therapy	rubefacient	SMDC Pharmakon
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

No pre-computed analogs available. Try a structural similarity search.