Structure Info
- Chemspace ID
- CSMB00009897219 (Enamine MADE)
- CAS
- 4935-00-6
- MFCD
- MFCD20625735, MFCD27987094, MFCD27987093
- IUPAC Name
- methyl 3-bromocyclobutane-1-carboxylate
- Mol formula
- C6H9BrO2
- Mol weight
- 193 Da
- Catalog Number(s)
- 38009, 170253, A153529, A279000097, AA00DL8Y, AC044200, ACDS-032716, AG00DLBQ, AG151708, AG33966, AO33966, AOS00DLBQ, AR00DM0Q, AS-34051, ArZ-UP107013, BB4LS-PB07109, BBV-39906708, BD300652, CD13012398, CM108080, CS-0049107, CSC009897219, D496601, EAA93500, EN300-251358, F467614, FCH1204837, H-8052, HY-W057253, JH688856, LAN-B44120, LQT-B44203, M220058, M3616, NQC77196, OR942222, PB07109, SAB-082289, SC-B7444, SY031789, Y53405, YKC61835, ZX-AE046714, ZXC227249
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.3
- Heavy atoms count
- 9
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00009897219
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