Methyl nicotinate
CAS: 93-60-7
|
Purity: 99.00%
Ideal for Discovery & Screening This is for information only — not enforced.
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Cas_Number:
93-60-7
Smiles:
COC(=O)C1=CN=CC=C1
Tpsa:
39.2
Inchi:
InChI=1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3
Xlogp:
0.8
Inchikey:
YNBADRVTZLEFNH-UHFFFAOYSA-N
Unit Price:
7.66386
Data_Source:
pubchem
Pubchem_Cas:
93-60-7
Sub_Categories:
['building-blocks']
Heavy_Atom_Count:
10
Molecular_Weight:
137.14
Molecular_Formula:
C7H7NO2
Connectivity_Smiles:
COC(=O)C1=CN=CC=C1
Hbond_Acceptor_Count:
3
Rotatable_Bond_Count:
2
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