UCSF

ZINC01677799

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 14 No

Popular Name: Acetic acid n-decyl ester Acetic acid n-decyl ester

Find On: PubMed — Wikipedia — Google

CAS Number: 112-17-4

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) 4.85 9.36 -4.85 0 2 0 26 200.322 10 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 244? Alfa-Aesar
Boiling_Point 244° Alfa-Aesar
PUBCHEM_PATENT_ID EP0369812A2; US5059611 IBM Patent Data

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