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Home > Indoles and Oxindole > 1216252-53-7
1216252-53-7 | 5-METHOXY-1H-INDOLE-3-SULFONYL CHLORIDE
CAS No: 1216252-53-7 Catalog No: AG01BTTI MDL No:MFCD12402496
Product Description
Catalog Number:
AG01BTTI
Chemical Name:
5-METHOXY-1H-INDOLE-3-SULFONYL CHLORIDE
CAS Number:
1216252-53-7
Molecular Formula:
C9H8ClNO3S
Molecular Weight:
245.6827
MDL Number:
MFCD12402496
IUPAC Name:
5-methoxy-1H-indole-3-sulfonyl chloride
InChI:
InChI=1S/C9H8ClNO3S/c1-14-6-2-3-8-7(4-6)9(5-11-8)15(10,12)13/h2-5,11H,1H3
InChI Key:
DTCNOVOJCDUXDP-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(c[nH]2)S(=O)(=O)Cl
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.991g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.677g/mol
Monoisotopic Mass:
244.991g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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