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88150-29-2

88150-29-2 | 1H-Indole, 1-acetyl-6-methyl-

CAS No: 88150-29-2 Catalog No: AG004D36 MDL No:

Product Description

Catalog Number:
AG004D36
Chemical Name:
1H-Indole, 1-acetyl-6-methyl-
CAS Number:
88150-29-2
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
IUPAC Name:
1-(6-methylindol-1-yl)ethanone
InChI:
InChI=1S/C11H11NO/c1-8-3-4-10-5-6-12(9(2)13)11(10)7-8/h3-7H,1-2H3
InChI Key:
QYEGNXQXGDOYCK-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)n(cc2)C(=O)C

Properties

Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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