UCSF

ZINC00270485

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 12 Yes

Popular Name: 2-Phenyl-cyclopropanecarboxylic acid 2-Phenyl-cyclopropanecarboxylic …

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CAS Numbers: 3471-10-1 , 5685-38-1 , 939-36-2 , 939-89-9 , 939-90-2 , [5685-38-1]

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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) 1.77 6.3 -48.88 0 2 -1 40 161.18 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 85 - 87 Enamine Building Blocks
MP 85...87 Enamine Building Blocks
Mp [°C] 86 - 92 Acros Organics
MP 88 TCI
MP 89-90° Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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