Structure Info
- Chemspace ID
- CSMB00011213362 (Enamine MADE)
- CAS
- 78955-90-5
- MFCD
- MFCD09800922
- IUPAC Name
- methyl 4-chloro-2-methoxybenzoate
- Mol formula
- C9H9ClO3
- Mol weight
- 201 Da
- Catalog Number(s)
- 126746, 2347AC, 37048, 134425, 78955-90-5, A013027858, A536102, AA008NAC, ACDS-042749, ACM78955905, AE03328, AG008ND4, AM03328, AR008O24, ArZ-UP098721, BB4LS-BD243351, BBV-33133334, BD243351, BS-25944, CD12030842, CS-0127627, CSC011213362, CSCR00000503802, DDA95590, E78386, F236518, HY-W087390, JH482195, LAN-B75857, LN01326556, M295600, OR11925, SAB-066693, SY396800, Y1236034, Z295154322, ZX-AE038422, ZXC173264, s_1458_2163076_483916, s_1458____2163076____483916
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.42
- Heavy atoms count
- 13
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00011213362
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