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1595785-98-0 | 5-(3-hydroxy-3-methylpiperidin-1-yl)furan-2-carbaldehyde
CAS No: 1595785-98-0 Catalog No: AG01C8KI MDL No:MFCD31443144
Product Description
Catalog Number:
AG01C8KI
Chemical Name:
5-(3-hydroxy-3-methylpiperidin-1-yl)furan-2-carbaldehyde
CAS Number:
1595785-98-0
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
MDL Number:
MFCD31443144
IUPAC Name:
5-(3-hydroxy-3-methylpiperidin-1-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C11H15NO3/c1-11(14)5-2-6-12(8-11)10-4-3-9(7-13)15-10/h3-4,7,14H,2,5-6,8H2,1H3
InChI Key:
IKVOUTFCSYKSGK-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)N1CCCC(C1)(C)O
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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