Structure Info
- Chemspace ID
- CSSS00000137442 (In-Stock Screening Compounds)
- CAS
- 53578-15-7, 1159813-53-2
- MFCD
- MFCD10568733, MFCD29060095
- IUPAC Name
- cubane-1-carboxylic acid
- Mol formula
- C9H8O2
- Mol weight
- 148 Da
- Catalog Number(s)
- 4296BB, A943242, AA00E3AE, AB02915, AG-B23044, AG00E3D6, AG57346, AO57346, AR00E426, AS-79163, BB4LS-EN300-93169, BBV-38409851, BD221982, C3808, CM460968, CS-0052586, CSC000137442, D963566, DCA57815, EN300-93169, F516270, FCH19901010, FCH3938870, HY-W060732, JH329363, LN04667640, OR312529, P18358, P18358-0.25G, P45503, PBLJ0576, SY076091, U64372, Y1096655, Z1205493725
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.07
- Heavy atoms count
- 11
- Rotatable bond count
- 1
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.888
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00000137442
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