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Home > Imidazoles > 174610-38-9
174610-38-9 | 1H-Indole-3-ethanol, 5-(1H-imidazol-1-ylmethyl)-
CAS No: 174610-38-9 Catalog No: AG001ZTM MDL No:
Product Description
Catalog Number:
AG001ZTM
Chemical Name:
1H-Indole-3-ethanol, 5-(1H-imidazol-1-ylmethyl)-
CAS Number:
174610-38-9
Molecular Formula:
C14H15N3O
Molecular Weight:
241.2884
IUPAC Name:
2-[5-(imidazol-1-ylmethyl)-1H-indol-3-yl]ethanol
InChI:
InChI=1S/C14H15N3O/c18-6-3-12-8-16-14-2-1-11(7-13(12)14)9-17-5-4-15-10-17/h1-2,4-5,7-8,10,16,18H,3,6,9H2
InChI Key:
XNQBXDPRVWUWSV-UHFFFAOYSA-N
SMILES:
OCCc1c[nH]c2c1cc(cc2)Cn1cncc1
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.122g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.294g/mol
Monoisotopic Mass:
241.122g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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