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88073-46-5 | 1-Propanamine, N,N-dimethyl-3,3-bis(phenylsulfonyl)-
CAS No: 88073-46-5 Catalog No: AG004HQ4 MDL No:
Product Description
Catalog Number:
AG004HQ4
Chemical Name:
1-Propanamine, N,N-dimethyl-3,3-bis(phenylsulfonyl)-
CAS Number:
88073-46-5
Molecular Formula:
C17H21NO4S2
Molecular Weight:
367.4829
IUPAC Name:
3,3-bis(benzenesulfonyl)-N,N-dimethylpropan-1-amine
InChI:
InChI=1S/C17H21NO4S2/c1-18(2)14-13-17(23(19,20)15-9-5-3-6-10-15)24(21,22)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3
InChI Key:
JNVQAZVWMUXCOL-UHFFFAOYSA-N
SMILES:
CN(CCC(S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1)C
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.091g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.478g/mol
Monoisotopic Mass:
367.091g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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