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21005-60-7 | 1H-Indole-5-ethanamine
CAS No: 21005-60-7 Catalog No: AG002KKO MDL No:MFCD08448752
Product Description
Catalog Number:
AG002KKO
Chemical Name:
1H-Indole-5-ethanamine
CAS Number:
21005-60-7
Molecular Formula:
C10H12N2
Molecular Weight:
160.2157
MDL Number:
MFCD08448752
IUPAC Name:
2-(1H-indol-5-yl)ethanamine
InChI:
InChI=1S/C10H12N2/c11-5-3-8-1-2-10-9(7-8)4-6-12-10/h1-2,4,6-7,12H,3,5,11H2
InChI Key:
ALEWOQWOFUSKHR-UHFFFAOYSA-N
SMILES:
NCCc1ccc2c(c1)cc[nH]2
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
160.22g/mol
Monoisotopic Mass:
160.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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