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1064048-61-8 | N-[(pyrrolidin-3-yl)methyl]methanesulfonamide
CAS No: 1064048-61-8 Catalog No: AG01BYMM MDL No:MFCD20482579
Product Description
Catalog Number:
AG01BYMM
Chemical Name:
N-[(pyrrolidin-3-yl)methyl]methanesulfonamide
CAS Number:
1064048-61-8
Molecular Formula:
C6H14N2O2S
Molecular Weight:
178.2526
MDL Number:
MFCD20482579
IUPAC Name:
N-(pyrrolidin-3-ylmethyl)methanesulfonamide
InChI:
InChI=1S/C6H14N2O2S/c1-11(9,10)8-5-6-2-3-7-4-6/h6-8H,2-5H2,1H3
InChI Key:
PCAPUMJQKJGNGT-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)NCC1CNCC1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.078g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.25g/mol
Monoisotopic Mass:
178.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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