UCSF

ZINC00167575

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 18 Yes

Popular Name: 5-(3-chlorophenoxy)-1,3-dimethyl-1H-pyrazole-4-carboxylic acid 5-(3-chlorophenoxy)-1,3-dimethyl…

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CAS Number: 446276-24-0

Download: MOL2 SDF SMILES Flexibase

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) 2.64 6.49 -49.87 0 5 -1 67 265.676 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 189-191° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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