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1315366-55-2 | 1-propanoyl-1,2,3,4-tetrahydroquinoline-7-sulfonyl chloride
CAS No: 1315366-55-2 Catalog No: AG01AJ4T MDL No:MFCD19382064
Product Description
Catalog Number:
AG01AJ4T
Chemical Name:
1-propanoyl-1,2,3,4-tetrahydroquinoline-7-sulfonyl chloride
CAS Number:
1315366-55-2
Molecular Formula:
C12H14ClNO3S
Molecular Weight:
287.7625
MDL Number:
MFCD19382064
IUPAC Name:
1-propanoyl-3,4-dihydro-2H-quinoline-7-sulfonyl chloride
InChI:
InChI=1S/C12H14ClNO3S/c1-2-12(15)14-7-3-4-9-5-6-10(8-11(9)14)18(13,16)17/h5-6,8H,2-4,7H2,1H3
InChI Key:
PICBATXLCHOZBI-UHFFFAOYSA-N
SMILES:
CCC(=O)N1CCCc2c1cc(cc2)S(=O)(=O)Cl
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.038g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.758g/mol
Monoisotopic Mass:
287.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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