UCSF

ZINC02017921

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 7 No

Popular Name: Methyl 2-chloropropionate Methyl 2-chloropropionate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 17639-93-9 , 73246-45-4 , 73246-45-4; 77287-29-7 , 77287-29-7 , [17639-93-9] , [77287-29-7]

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) 1.14 3.51 -4.79 0 2 0 26 122.551 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 132 TCI
Boiling_Point 132-133? Alfa-Aesar
Boiling_Point 132-133° Alfa-Aesar
BP 134 TCI
Purity 95% Fluorochem
Purity 97% Fluorochem
Melting_Point <-10? Alfa-Aesar
Melting_Point <-10° Alfa-Aesar

Activity (Go SEA)

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