UCSF

ZINC02169728

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 13 Yes

Popular Name: Isopropyl 2-aminobenzoate Isopropyl 2-aminobenzoate

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CAS Numbers: 18189-02-1 , [18189-02-1]

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) 2.46 0.78 -5.19 2 3 0 52 179.219 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 270-272° Matrix Scientific
MP 64-65° Matrix Scientific
Purity 99% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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