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290328-53-9 | Piperidine, 4-[(methylsulfonyl)methyl]-
CAS No: 290328-53-9 Catalog No: AG002V9W MDL No:MFCD12197684
Product Description
Catalog Number:
AG002V9W
Chemical Name:
Piperidine, 4-[(methylsulfonyl)methyl]-
CAS Number:
290328-53-9
Molecular Formula:
C7H15NO2S
Molecular Weight:
177.2645
MDL Number:
MFCD12197684
IUPAC Name:
4-(methylsulfonylmethyl)piperidine
InChI:
InChI=1S/C7H15NO2S/c1-11(9,10)6-7-2-4-8-5-3-7/h7-8H,2-6H2,1H3
InChI Key:
LGYCYNNJLVQISG-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)CC1CCNCC1
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.082g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.262g/mol
Monoisotopic Mass:
177.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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