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Home > Indoles and Oxindole > 1306607-01-1
1306607-01-1 | 2-acetyl-2,3-dihydro-1H-isoindole-5-sulfonyl chloride
CAS No: 1306607-01-1 Catalog No: AG01AI8I MDL No:MFCD18838931
Product Description
Catalog Number:
AG01AI8I
Chemical Name:
2-acetyl-2,3-dihydro-1H-isoindole-5-sulfonyl chloride
CAS Number:
1306607-01-1
Molecular Formula:
C10H10ClNO3S
Molecular Weight:
259.7093
MDL Number:
MFCD18838931
IUPAC Name:
2-acetyl-1,3-dihydroisoindole-5-sulfonyl chloride
InChI:
InChI=1S/C10H10ClNO3S/c1-7(13)12-5-8-2-3-10(16(11,14)15)4-9(8)6-12/h2-4H,5-6H2,1H3
InChI Key:
URRSOISMHKEOJC-UHFFFAOYSA-N
SMILES:
CC(=O)N1Cc2c(C1)cc(cc2)S(=O)(=O)Cl
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.007g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.704g/mol
Monoisotopic Mass:
259.007g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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