Chemical Compound
Rel-4-methylbenzyl (3R,4S)-4-(aminomethyl)-3-fluoropiperidine-1-carboxylate
CAS Registry Number808733-20-2
Primary record
Rel-4-methylbenzyl (3R,4S)-4-(aminomethyl)-3-fluoropiperidine-1-carboxylate
- CAS
- 808733-20-2
- PubChem CID
- 69055873
- SMILES
- CC1=CC=C(C=C1)COC(=O)N2CC[C@H]([C@H](C2)F)CN
- Molecular Formula
- C15H21FN2O2
- Molecular Weight
- 280.343
- Exact Mass
- 280.1587
- InChI
- InChI=1S/C15H21FN2O2/c1-11-2-4-12(5-3-11)10-20-15(19)18-7-6-13(8-17)14(16)9-18/h2-5,13-14H,6-10,17H2,1H3/t13-,14-/m0/s1
- InChIKey
- COWPAITVMXHKRU-KBPBESRZSA-N
- LogP
- 2.2503
- TPSA
- 55.56
Names and synonyms
- SCHEMBL4470787
- Rel-4-methylbenzyl (3R,4S)-4-(aminomethyl)-3-fluoropiperidine-1-carboxylate
- 808733-20-2