200,000+ products from a single source!
sales@angenechem.com
86447-15-6 | 3-Pyridinecarboxylic acid, 1,2,3,6-tetrahydro-1-methyl-, methyl ester
CAS No: 86447-15-6 Catalog No: AG004QUU MDL No:
Product Description
Catalog Number:
AG004QUU
Chemical Name:
3-Pyridinecarboxylic acid, 1,2,3,6-tetrahydro-1-methyl-, methyl ester
CAS Number:
86447-15-6
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
IUPAC Name:
methyl 1-methyl-3,6-dihydro-2H-pyridine-3-carboxylate
InChI:
InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h3-4,7H,5-6H2,1-2H3
InChI Key:
LGPGDOKRMJRCLE-UHFFFAOYSA-N
SMILES:
COC(=O)C1C=CCN(C1)C
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.197g/mol
Monoisotopic Mass:
155.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.