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1216155-73-5 | decahydroquinoline-1-sulfonyl chloride
CAS No: 1216155-73-5 Catalog No: AG019YML MDL No:MFCD12095780
Product Description
Catalog Number:
AG019YML
Chemical Name:
decahydroquinoline-1-sulfonyl chloride
CAS Number:
1216155-73-5
Molecular Formula:
C9H16ClNO2S
Molecular Weight:
237.7468
MDL Number:
MFCD12095780
IUPAC Name:
3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-sulfonyl chloride
InChI:
InChI=1S/C9H16ClNO2S/c10-14(12,13)11-7-3-5-8-4-1-2-6-9(8)11/h8-9H,1-7H2
InChI Key:
BNQYEMFKTOEOFX-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)N1CCCC2C1CCCC2
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.742g/mol
Monoisotopic Mass:
237.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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