UCSF

ZINC03861663

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 26 No

CAS Number: 67-42-5

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Annotations

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Vendors

Physical Representations

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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -4.92 -0.4 -147.61 2 12 -2 187 378.334 17

Vendor Notes

Note Type Comments Provided By
Melting_Point ca 242? dec. Alfa-Aesar
Melting_Point ca 242° dec. Alfa-Aesar

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