ethyl 1-(iodomethyl)-3-[1-(propan-2-yl)-1H-pyrazol-4-yl]-2-oxabicyclo[2.2.2]octane-4-carboxylate | C17H25IN2O3 | 2703779-45-5 | MFCD34551025 | CCOC(=O)C12CCC(CI)(CC1)OC2C1=CN(N=C1)C(C)C | ArZ-UP354703, BB4LS-EN300-33039562, BL33463, EN300-33039562, Y3224417, ZXC357279 | Chemspace

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Home Chemical search Search Results CSCS06256033385

Structure Info

Chemspace ID: CSCS06256033385 (Synthesis)

CAS: 2703779-45-5

MFCD: MFCD34551025

IUPAC Name: ethyl 1-(iodomethyl)-3-[1-(propan-2-yl)-1H-pyrazol-4-yl]-2-oxabicyclo[2.2.2]octane-4-carboxylate

Mol formula: C₁₇H₂₅IN₂O₃

Mol weight: 432 Da

Catalog Number(s): ArZ-UP354703, BB4LS-EN300-33039562, BL33463, EN300-33039562, Y3224417, ZXC357279

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INCHI
INCHI key
MOL

Properties
SDS

Properties

LogP: 3.48

Heavy atoms count: 23

Rotatable bond count: 6

Number of rings: 3

Carbon bond saturation, Fsp3: 0.764

Polar surface area (Å): 53

Hydrogen bond acceptors count: 3

Hydrogen bond donors count: 0

: Zoom the structure; CSCS06256033385

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Description: CAS: 2703779-45-5

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