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Home > Indoles and Oxindole > 879562-21-7
879562-21-7 | 1-Cyclopropanecarbonyl-2,3-dihydro-1H-indole-5-sulfonyl chloride
CAS No: 879562-21-7 Catalog No: AG01EY5H MDL No:
Product Description
Catalog Number:
AG01EY5H
Chemical Name:
1-Cyclopropanecarbonyl-2,3-dihydro-1H-indole-5-sulfonyl chloride
CAS Number:
879562-21-7
Molecular Formula:
C12H12ClNO3S
Molecular Weight:
285.7466
IUPAC Name:
1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-sulfonyl chloride
InChI:
InChI=1S/C12H12ClNO3S/c13-18(16,17)10-3-4-11-9(7-10)5-6-14(11)12(15)8-1-2-8/h3-4,7-8H,1-2,5-6H2
InChI Key:
QZQRQRONDFXNPD-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c1ccc(c2)S(=O)(=O)Cl)C1CC1
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.023g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.742g/mol
Monoisotopic Mass:
285.023g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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