Structure Info
- Chemspace ID
- CSMB00010202955 (Enamine MADE)
- CAS
- 795303-16-1
- MFCD
- MFCD15976407
- IUPAC Name
- 4-(difluoromethoxy)-2-methyl-1-nitrobenzene
- Mol formula
- C8H7F2NO3
- Mol weight
- 203 Da
- Catalog Number(s)
- A013000905, AA0051B9, AG0051E1, AG168418, AOS0051E1, AR005231, AS-67010, B046331, BBV-40267654, BD320987, CD12030423, CS-0280504, CSC010202955, D45061, D766693, EN300-105745, F070137, FCH1391547, FD88066, HY-W217956, JH483905, LAN-B27079, LN00271859, LQT-B27129, OSSL_762008, PBMR134584, SAB-051234, W16589
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.2
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.25
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00010202955
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