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95202-72-5 | Ethanone, 2-azido-1-(1-methyl-1H-indol-3-yl)-
CAS No: 95202-72-5 Catalog No: AG005SPX MDL No:
Product Description
Catalog Number:
AG005SPX
Chemical Name:
Ethanone, 2-azido-1-(1-methyl-1H-indol-3-yl)-
CAS Number:
95202-72-5
Molecular Formula:
C11H10N4O
Molecular Weight:
214.2233
IUPAC Name:
2-azido-1-(1-methylindol-3-yl)ethanone
InChI:
InChI=1S/C11H10N4O/c1-15-7-9(11(16)6-13-14-12)8-4-2-3-5-10(8)15/h2-5,7H,6H2,1H3
InChI Key:
SLCWCYQPTDSZSE-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=NCC(=O)c1cn(c2c1cccc2)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.228g/mol
Monoisotopic Mass:
214.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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