UCSF

ZINC00111420

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: tert-butyl N-(4-chlorophenyl)carbamate tert-butyl N-(4-chlorophenyl)car…

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CAS Numbers: 18437-66-6 , [18437-66-6]

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) 3.51 0.26 -5.32 1 3 0 38 227.691 3 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 102 - 106 Acros Organics
MP 103-105° Fluorochem
Purity 97% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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