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Home > Indoles and Oxindole > 2060031-98-1
2060031-98-1 | 1-[1-(benzyloxy)ethenyl]-1H-indole-6-sulfonyl chloride
CAS No: 2060031-98-1 Catalog No: AG01BY0L MDL No:MFCD30486502
Product Description
Catalog Number:
AG01BY0L
Chemical Name:
1-[1-(benzyloxy)ethenyl]-1H-indole-6-sulfonyl chloride
CAS Number:
2060031-98-1
Molecular Formula:
C17H14ClNO3S
Molecular Weight:
347.8160
MDL Number:
MFCD30486502
IUPAC Name:
1-(1-phenylmethoxyethenyl)indole-6-sulfonyl chloride
InChI:
InChI=1S/C17H14ClNO3S/c1-13(22-12-14-5-3-2-4-6-14)19-10-9-15-7-8-16(11-17(15)19)23(18,20)21/h2-11H,1,12H2
InChI Key:
NCIODMRCHKBXHG-UHFFFAOYSA-N
SMILES:
C=C(n1ccc2c1cc(cc2)S(=O)(=O)Cl)OCc1ccccc1
Properties
Complexity:
524
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.038g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.813g/mol
Monoisotopic Mass:
347.038g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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