CID 11240657

Base Information

• Chemical Name: CID 11240657
• CAS No.: 221196-91-4
• Molecular Formula: C7H12ClNO
• Molecular Weight: 161.631
• DSSTox Substance ID: DTXSID00459731
• Nikkaji Number: J1.558.293F
• Wikidata: Q82283560
• Mol file: 221196-91-4.mol

Synonyms:221196-91-4;SCHEMBL4585549;DTXSID00459731;(4S)-2-(chloromethyl)-4-propan-2-yl-4,5-dihydro-1,3-oxazole

Chemical Property of CID 11240657

Chemical Property:

• PSA: 21.59000
• LogP: 1.11410
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 161.0607417
• Heavy Atom Count: 10
• Complexity: 145

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1COC(=N1)CCl
• Isomeric SMILES: CC(C)[C@H]1COC(=N1)CCl

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