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1156429-26-3 | Methanone, 1,3-benzodioxol-5-yl[2-(hydroxymethyl)-1-piperidinyl]-
CAS No: 1156429-26-3 Catalog No: AG000GO7 MDL No:MFCD11925792
Product Description
Catalog Number:
AG000GO7
Chemical Name:
Methanone, 1,3-benzodioxol-5-yl[2-(hydroxymethyl)-1-piperidinyl]-
CAS Number:
1156429-26-3
Molecular Formula:
C14H17NO4
Molecular Weight:
263.2891
MDL Number:
MFCD11925792
IUPAC Name:
1,3-benzodioxol-5-yl-[2-(hydroxymethyl)piperidin-1-yl]methanone
InChI:
InChI=1S/C14H17NO4/c16-8-11-3-1-2-6-15(11)14(17)10-4-5-12-13(7-10)19-9-18-12/h4-5,7,11,16H,1-3,6,8-9H2
InChI Key:
DPXVPFXAQQSMND-UHFFFAOYSA-N
SMILES:
OCC1CCCCN1C(=O)c1ccc2c(c1)OCO2
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.293g/mol
Monoisotopic Mass:
263.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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