UCSF

ZINC04283847

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2005 9 Yes

Popular Name: N-Methylcaprolactam N-Methylcaprolactam

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2556-73-2 , [2556-73-2]

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) 1.08 3.65 -7.74 0 2 0 20 127.187 0 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 106-108?/6mm Alfa-Aesar
Boiling_Point 106-108°/6mm Alfa-Aesar
BP 120 / 25 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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