200,000+ products from a single source!
sales@angenechem.com
88780-60-3 | 1-Piperidinecarboxaldehyde, 4-hydroxy-4-(4-methoxyphenyl)-
CAS No: 88780-60-3 Catalog No: AG008B4J MDL No:
Product Description
Catalog Number:
AG008B4J
Chemical Name:
1-Piperidinecarboxaldehyde, 4-hydroxy-4-(4-methoxyphenyl)-
CAS Number:
88780-60-3
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
IUPAC Name:
4-hydroxy-4-(4-methoxyphenyl)piperidine-1-carbaldehyde
InChI:
InChI=1S/C13H17NO3/c1-17-12-4-2-11(3-5-12)13(16)6-8-14(10-15)9-7-13/h2-5,10,16H,6-9H2,1H3
InChI Key:
VOVIGZKWXSDVEO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1(O)CCN(CC1)C=O
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.121g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.283g/mol
Monoisotopic Mass:
235.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.