UCSF

ZINC00164443

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 11 Yes

Popular Name: 2-amino-6-methylbenzoic acid 2-amino-6-methylbenzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 4389-50-8 , [4389-50-8]

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) 1.35 2.7 -52.02 2 3 -1 66 150.157 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 127° Matrix Scientific
MP 128 - 130 Enamine Building Blocks
MP 128...130 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 98% APIChem
Melting_Point ca 127? dec. Alfa-Aesar
Melting_Point ca 127° dec. Alfa-Aesar
Warnings IRRITANT Matrix Scientific

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