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251550-17-1 | 2H-Indol-2-one, 1,3-dihydro-3-(2-methylpropyl)-
CAS No: 251550-17-1 Catalog No: AG002QOB MDL No:MFCD06245571
Product Description
Catalog Number:
AG002QOB
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-(2-methylpropyl)-
CAS Number:
251550-17-1
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD06245571
IUPAC Name:
3-(2-methylpropyl)-1,3-dihydroindol-2-one
InChI:
InChI=1S/C12H15NO/c1-8(2)7-10-9-5-3-4-6-11(9)13-12(10)14/h3-6,8,10H,7H2,1-2H3,(H,13,14)
InChI Key:
UHNMEXRCASTLJV-UHFFFAOYSA-N
SMILES:
CC(CC1C(=O)Nc2c1cccc2)C
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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