Name: Name:methyl 4-{[4-(hydroxymethyl)piperidin-1-yl]methyl}benzoate
Brand: Angene
SKU: AG019TMV
Rating: 90 (10 reviews)

methyl 4-{[4-(hydroxymethyl)piperidin-1-yl]methyl}benzoate

CAS No.:

1094514-18-7

Catalog Number:

AG019TMV

Molecular Formula:

C15H21NO3

Molecular Weight:

263.3321

Catalog Number:

AG019TMV

Chemical Name:

methyl 4-{[4-(hydroxymethyl)piperidin-1-yl]methyl}benzoate

CAS Number:

1094514-18-7

Molecular Formula:

C15H21NO3

Molecular Weight:

263.3321

MDL Number:

MFCD12622259

IUPAC Name:

methyl 4-[[4-(hydroxymethyl)piperidin-1-yl]methyl]benzoate

InChI:

InChI=1S/C15H21NO3/c1-19-15(18)14-4-2-12(3-5-14)10-16-8-6-13(11-17)7-9-16/h2-5,13,17H,6-11H2,1H3

InChI Key:

PYBPXBBOZFWVOY-UHFFFAOYSA-N

SMILES:

OCC1CCN(CC1)Cc1ccc(cc1)C(=O)OC

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.152g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

263.337g/mol

Monoisotopic Mass:

263.152g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7