200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1250898-95-3
1250898-95-3 | Ethanone, 2-[2-(hydroxymethyl)-1-piperidinyl]-1-(2-thienyl)-
CAS No: 1250898-95-3 Catalog No: AG000N48 MDL No:MFCD16151949
Product Description
Catalog Number:
AG000N48
Chemical Name:
Ethanone, 2-[2-(hydroxymethyl)-1-piperidinyl]-1-(2-thienyl)-
CAS Number:
1250898-95-3
Molecular Formula:
C12H17NO2S
Molecular Weight:
239.3339
MDL Number:
MFCD16151949
IUPAC Name:
2-[2-(hydroxymethyl)piperidin-1-yl]-1-thiophen-2-ylethanone
InChI:
InChI=1S/C12H17NO2S/c14-9-10-4-1-2-6-13(10)8-11(15)12-5-3-7-16-12/h3,5,7,10,14H,1-2,4,6,8-9H2
InChI Key:
SKJHHNJKCLCXKU-UHFFFAOYSA-N
SMILES:
OCC1CCCCN1CC(=O)c1cccs1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.098g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.333g/mol
Monoisotopic Mass:
239.098g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.