UCSF

ZINC17975706

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 18 No

Popular Name: 2-benzyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione 2-benzyl-3a,4,7,7a-tetrahydro-1H…

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CAS Numbers: 130076-29-8 , N/A , [130076-29-8]

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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) 1.91 7.79 -6.78 0 3 0 37 241.29 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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