200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 102698-52-2
102698-52-2 | Benzoic acid, 4-ethoxy-, 1-methyl-4-piperidinyl ester
CAS No: 102698-52-2 Catalog No: AG000859 MDL No:
Product Description
Catalog Number:
AG000859
Chemical Name:
Benzoic acid, 4-ethoxy-, 1-methyl-4-piperidinyl ester
CAS Number:
102698-52-2
Molecular Formula:
C15H21NO3
Molecular Weight:
263.3321
IUPAC Name:
(1-methylpiperidin-4-yl) 4-ethoxybenzoate
InChI:
InChI=1S/C15H21NO3/c1-3-18-13-6-4-12(5-7-13)15(17)19-14-8-10-16(2)11-9-14/h4-7,14H,3,8-11H2,1-2H3
InChI Key:
NLNRFKWXAJZLTD-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)C(=O)OC1CCN(CC1)C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.337g/mol
Monoisotopic Mass:
263.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.