UCSF

ZINC38192629

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2010 14 Yes

Popular Name: D-(+)-Camphoric acid D-(+)-Camphoric acid

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CAS Numbers: 124-83-4 , 17839-62-2 , 560-09-8 , [124-83-4]

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 1.35 6.53 -111.84 0 4 -2 80 198.218 2 ↓
Lo Low (pH 4.5-6) 1.35 4.6 -51.35 1 4 -1 77 199.226 2 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 183 - 187 Acros Organics
Melting_Point 183-188? Alfa-Aesar
Melting_Point 183-188° Alfa-Aesar
MP 187 TCI
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0991619A1; WO1998058902A1 IBM Patent Data
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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