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Structure Info
- Chemspace ID
- CSSS00015974737 (In-Stock Screening Compounds)
- CAS
- 1369784-70-2
- MFCD
- MFCD28356927
- IUPAC Name
3-tert-butyl-4-methylbenzoic acid
- Mol formula
- C12H16O2
- Mol weight
- 192 Da
- Catalog Number(s)
BB4LS-EN300-6766911, BBV-82782547, BL57337, CSC015974737, EN300-6766911, Y3213622, Z3242283539, ZXC306373
Properties
- LogP
- 3.69
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.416
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
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