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161308-34-5 | 1-Butanesulfonic acid, 4-(cyclohexylamino)-
CAS No: 161308-34-5 Catalog No: AG001SBG MDL No:
Product Description
Catalog Number:
AG001SBG
Chemical Name:
1-Butanesulfonic acid, 4-(cyclohexylamino)-
CAS Number:
161308-34-5
Molecular Formula:
C10H21NO3S
Molecular Weight:
235.3436
IUPAC Name:
4-(cyclohexylamino)butane-1-sulfonic acid
InChI:
InChI=1S/C10H21NO3S/c12-15(13,14)9-5-4-8-11-10-6-2-1-3-7-10/h10-11H,1-9H2,(H,12,13,14)
InChI Key:
XNPKNHHFCKSMRV-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)CCCCNC1CCCCC1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.124g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
235.342g/mol
Monoisotopic Mass:
235.124g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
Literature
| Title | Journal |
|---|---|
| The Trypanosoma cruzi virulence factor oligopeptidase B (OPBTc) assembles into an active and stable dimer. | PloS one 20120101 |
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