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1260757-80-9 | 1H-Indole-3-carbonyl chloride, 1-acetyl-
CAS No: 1260757-80-9 Catalog No: AG000R3K MDL No:
Product Description
Catalog Number:
AG000R3K
Chemical Name:
1H-Indole-3-carbonyl chloride, 1-acetyl-
CAS Number:
1260757-80-9
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
IUPAC Name:
1-acetylindole-3-carbonyl chloride
InChI:
InChI=1S/C11H8ClNO2/c1-7(14)13-6-9(11(12)15)8-4-2-3-5-10(8)13/h2-6H,1H3
InChI Key:
WWZUJJQAZYGWPL-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cn(c2c1cccc2)C(=O)C
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.024g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.64g/mol
Monoisotopic Mass:
221.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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