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1018285-68-1 | Piperidine, 4-[(ethylsulfonyl)methyl]-
CAS No: 1018285-68-1 Catalog No: AG0005NB MDL No:MFCD26792997
Product Description
Catalog Number:
AG0005NB
Chemical Name:
Piperidine, 4-[(ethylsulfonyl)methyl]-
CAS Number:
1018285-68-1
Molecular Formula:
C8H17NO2S
Molecular Weight:
191.2911
MDL Number:
MFCD26792997
IUPAC Name:
4-(ethylsulfonylmethyl)piperidine
InChI:
InChI=1S/C8H17NO2S/c1-2-12(10,11)7-8-3-5-9-6-4-8/h8-9H,2-7H2,1H3
InChI Key:
UFTVDUBJJOFWMV-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)CC1CCNCC1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.098g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.289g/mol
Monoisotopic Mass:
191.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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