UCSF

ZINC08782182

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2007 15 No

Popular Name: 6-chloro-2-(2-chloroethyl)-2H-1,4-benzoxazin-3(4H)-one 6-chloro-2-(2-chloroethyl)-2H-1,…

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CAS Number: 865658-35-1

Other Names:

MFCD03787075

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) 2.50 4.35 -6.14 1 3 0 38 246.093 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 184 - 186 KeyOrganics

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