UCSF

ZINC00404793

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 12 Yes

Popular Name: 2-Chloro-6-fluorophenylacetic acid 2-Chloro-6-fluorophenylacetic acid

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CAS Numbers: 37777-76-7 , [37777-76-7]

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) 2.11 1.6 -49.78 0 2 -1 40 187.577 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 120 - 123 Enamine Building Blocks
MP 120-123° Matrix Scientific
Melting_Point 120-124? Alfa-Aesar
Melting_Point 120-124° Alfa-Aesar
MP 120...123 Enamine Building Blocks
MP 123 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% APIChem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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