Ethyl 2-acetylhexanoate
Structure Info
- Chemspace ID
- CSSS00011215151 (In-Stock Screening Compounds)
- CAS
- 1540-29-0
- MFCD
- MFCD00026888, MFCD00005637, MFCD00026888
- IUPAC Name
- ethyl 2-acetylhexanoate
- Mol formula
- C10H18O3
- Mol weight
- 186 Da
- Catalog Number(s)
- 1540-29-0, A490017110, A493755, AA003Q04, AB73568, AC032700, ACDS-042338, ACM1540290, AG003Q2W, AJ73568, ALBB-021832, AOS003Q2W, AR003QRW, AS-16161, ArZ-UP089240, ArZ-UP156597, ArZ-UP163413, B0702, BB010965, BB4LS-EN300-49173, BB57-3301, BBV-34552614, BD128388, CD13021824, CS-0152388, CSC011215151, D70262, D748835, D914080, E896423, EN300-49173, F242208, FE129925, HY-W099746, J62598, JH638912, LAN-B41086, LN00179007, LQT-B41162, OR27986, R031553, S830, SAB-026065, SY036832, W162409, Z586249222, ZX-AE028941, ZX-ARV09794, ZX-CH078085, ZX-IP091079, ZX-NM206688
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.38
- Heavy atoms count
- 13
- Rotatable bond count
- 7
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.8
- Polar surface area (Å)
- 43
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
  
- Zoom the structure
- CSSS00011215151
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