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191927-74-9 | 1H-Indole-3-ethanamine, 7-fluoro-
CAS No: 191927-74-9 Catalog No: AG002FJH MDL No:MFCD02683931
Product Description
Catalog Number:
AG002FJH
Chemical Name:
1H-Indole-3-ethanamine, 7-fluoro-
CAS Number:
191927-74-9
Molecular Formula:
C10H11FN2
Molecular Weight:
178.2061
MDL Number:
MFCD02683931
IUPAC Name:
2-(7-fluoro-1H-indol-3-yl)ethanamine
InChI:
InChI=1S/C10H11FN2/c11-9-3-1-2-8-7(4-5-12)6-13-10(8)9/h1-3,6,13H,4-5,12H2
InChI Key:
QRAWNNQNLQPNIZ-UHFFFAOYSA-N
SMILES:
NCCc1c[nH]c2c1cccc2F
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.091g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.21g/mol
Monoisotopic Mass:
178.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Substrate specificity of strictosidine synthase. | Bioorganic & medicinal chemistry letters 20060501 |
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