UCSF

ZINC00153097

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 10 Yes

Popular Name: 2-Amino-6-chlorobenzonitrile 2-Amino-6-chlorobenzonitrile

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CAS Numbers: 07/11/75 , 11/7/6575 12:00:00 AM , 147249-41-0 , 1707821.0 , 6575-11-7 , 6626-15-9 , [6575-11-7]

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) 1.76 3.16 -6.81 2 2 0 50 152.584 0 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 133-137? Alfa-Aesar
Melting_Point 133-137° Alfa-Aesar
MP 134-136° Oakwood Chemical
Purity 98% Fluorochem

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