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137090-15-4 | Phosphinothioic acid, di-1-piperidinyl-, S-methyl ester (9CI)
CAS No: 137090-15-4 Catalog No: AG0012U4 MDL No:
Product Description
Catalog Number:
AG0012U4
Chemical Name:
Phosphinothioic acid, di-1-piperidinyl-, S-methyl ester (9CI)
CAS Number:
137090-15-4
Molecular Formula:
C11H23N2OPS
Molecular Weight:
262.3519
IUPAC Name:
1-[methylsulfanyl(piperidin-1-yl)phosphoryl]piperidine
InChI:
InChI=1S/C11H23N2OPS/c1-16-15(14,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H2,1H3
InChI Key:
UAEQYONNDBIOEH-UHFFFAOYSA-N
SMILES:
CSP(=O)(N1CCCCC1)N1CCCCC1
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.127g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.352g/mol
Monoisotopic Mass:
262.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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