UCSF

ZINC12405245

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2008 21 Yes

Popular Name: Methyl linolenate Methyl linolenate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 301-00-8 , 7361-80-0 , [301-00-8] , [3840-38-1]

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) 6.15 4.74 -5.28 0 2 0 26 292.463 14 ↓

Vendor Notes

Note Type Comments Provided By
MP 57 TCI
BP [°C] 182 (p=3 torr) Acros Organics
BP 207 / 14 TCI
Purity 80% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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