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1417794-04-7 | 3-Pyrrolidinamine, 1-[(2-methoxyphenyl)sulfonyl]-, hydrochloride (1:1)
CAS No: 1417794-04-7 Catalog No: AG001H5O MDL No:
Product Description
Catalog Number:
AG001H5O
Chemical Name:
3-Pyrrolidinamine, 1-[(2-methoxyphenyl)sulfonyl]-, hydrochloride (1:1)
CAS Number:
1417794-04-7
Molecular Formula:
C11H17ClN2O3S
Molecular Weight:
292.7823
IUPAC Name:
1-(2-methoxyphenyl)sulfonylpyrrolidin-3-amine;hydrochloride
InChI:
InChI=1S/C11H16N2O3S.ClH/c1-16-10-4-2-3-5-11(10)17(14,15)13-7-6-9(12)8-13;/h2-5,9H,6-8,12H2,1H3;1H
InChI Key:
SGTCPCMIIYPOHN-UHFFFAOYSA-N
SMILES:
COc1ccccc1S(=O)(=O)N1CCC(C1)N.Cl
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.065g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
292.778g/mol
Monoisotopic Mass:
292.065g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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