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943526-33-8 | 2H-Indol-2-one, 4-chloro-1,3-dihydro-7-methyl-
CAS No: 943526-33-8 Catalog No: AG0039C6 MDL No:MFCD21961280
Product Description
Catalog Number:
AG0039C6
Chemical Name:
2H-Indol-2-one, 4-chloro-1,3-dihydro-7-methyl-
CAS Number:
943526-33-8
Molecular Formula:
C9H8ClNO
Molecular Weight:
181.6189
MDL Number:
MFCD21961280
IUPAC Name:
4-chloro-7-methyl-1,3-dihydroindol-2-one
InChI:
InChI=1S/C9H8ClNO/c1-5-2-3-7(10)6-4-8(12)11-9(5)6/h2-3H,4H2,1H3,(H,11,12)
InChI Key:
UWAIMYDWOOZYGR-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(Cl)ccc2C
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.619g/mol
Monoisotopic Mass:
181.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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