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35308-68-0 | 2-Methyl-4,5,6,7-tetrahydro-1H-indol-4-one
CAS No: 35308-68-0 Catalog No: AG003HN3 MDL No:MFCD04972500
Product Description
Catalog Number:
AG003HN3
Chemical Name:
2-Methyl-4,5,6,7-tetrahydro-1H-indol-4-one
CAS Number:
35308-68-0
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
MDL Number:
MFCD04972500
IUPAC Name:
2-methyl-1,5,6,7-tetrahydroindol-4-one
InChI:
InChI=1S/C9H11NO/c1-6-5-7-8(10-6)3-2-4-9(7)11/h5,10H,2-4H2,1H3
InChI Key:
HJIYEKHYUGHTAC-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1cc([nH]2)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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