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Home > Indoles and Oxindole > 1379210-99-7
1379210-99-7 | 7-methanesulfonyl-2,3-dihydro-1H-indole
CAS No: 1379210-99-7 Catalog No: AG01AF4O MDL No:MFCD20259054
Product Description
Catalog Number:
AG01AF4O
Chemical Name:
7-methanesulfonyl-2,3-dihydro-1H-indole
CAS Number:
1379210-99-7
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
MDL Number:
MFCD20259054
IUPAC Name:
7-methylsulfonyl-2,3-dihydro-1H-indole
InChI:
InChI=1S/C9H11NO2S/c1-13(11,12)8-4-2-3-7-5-6-10-9(7)8/h2-4,10H,5-6H2,1H3
InChI Key:
TVXXYUQVEMZXOW-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)c1cccc2c1NCC2
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.252g/mol
Monoisotopic Mass:
197.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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