UCSF

ZINC02146858

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 12 Yes

Popular Name: 3-Chloro-4-methoxybenzoic acid 3-Chloro-4-methoxybenzoic acid

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CAS Number: 37908-96-6

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) 2.51 0.72 -47.16 0 3 -1 49 185.586 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 213-215° Fluorochem
Melting_Point 215-219? Alfa-Aesar
Melting_Point 215-219° Alfa-Aesar
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )