UCSF

ZINC00395503

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 12 Yes

Popular Name: Ethyl 4-hydroxycyclohexanecarboxylate Ethyl 4-hydroxycyclohexanecarbox…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 17159-80-7 , 3618-04-0 , 75877-66-6 , [17159-80-7] , [75877-66-6]

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) 1.22 3.15 -7.95 1 3 0 47 172.224 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 127-134?/0.1mm Alfa-Aesar
Boiling_Point 127-134°/0.1mm Alfa-Aesar
BP 144 / 12 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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