UCSF

ZINC02041054

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 10 Yes

Popular Name: 2-(Hexyloxy)ethanol 2-(Hexyloxy)ethanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 112-25-4 , [112-25-4]

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) 2.02 -1.66 -4.46 1 2 0 29 146.23 7 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 42? Alfa-Aesar
Melting_Point 42° Alfa-Aesar
BP 205 TCI
Boiling_Point 208? Alfa-Aesar
Boiling_Point 208° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP0550259B1 IBM Patent Data

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