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Home > Indoles and Oxindole > 75761-07-8
75761-07-8 | 6-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)hexane-1-sulfonyl chloride
CAS No: 75761-07-8 Catalog No: AG005IEW MDL No:
Product Description
Catalog Number:
AG005IEW
Chemical Name:
6-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)hexane-1-sulfonyl chloride
CAS Number:
75761-07-8
Molecular Formula:
C14H16ClNO4S
Molecular Weight:
329.7991
IUPAC Name:
6-(1,3-dioxoisoindol-2-yl)hexane-1-sulfonyl chloride
InChI:
InChI=1S/C14H16ClNO4S/c15-21(19,20)10-6-2-1-5-9-16-13(17)11-7-3-4-8-12(11)14(16)18/h3-4,7-8H,1-2,5-6,9-10H2
InChI Key:
FZZLKBDEGCRLMW-UHFFFAOYSA-N
SMILES:
O=C1N(CCCCCCS(=O)(=O)Cl)C(=O)c2c1cccc2
NSC Number:
51716
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.049g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.795g/mol
Monoisotopic Mass:
329.049g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
79.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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