1-Acetylpiperidine-4-carboxylic acid
CAS: 25503-90-6
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Purity: 98.00%
Ideal for Discovery & Screening This is for information only — not enforced.
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Cas_Number:
25503-90-6
Smiles:
CC(=O)N1CCC(CC1)C(=O)O
Tpsa:
57.6
Inchi:
InChI=1S/C8H13NO3/c1-6(10)9-4-2-7(3-5-9)8(11)12/h7H,2-5H2,1H3,(H,11,12)
Xlogp:
-0.3
Inchikey:
WFCLWJHOKCQYOQ-UHFFFAOYSA-N
Unit Price:
21.13
Data_Source:
pubchem
Pubchem_Cid:
117255
Heavy_Atom_Count:
12
Molecular_Weight:
171.19
Hbond_Donor_Count:
1
Molecular_Formula:
C8H13NO3
Connectivity_Smiles:
CC(=O)N1CCC(CC1)C(=O)O
Hbond_Acceptor_Count:
3
Rotatable_Bond_Count:
1
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