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83053-23-0 | 1H-Indole-3-methanol, a-(aminomethyl)-5-methoxy-
CAS No: 83053-23-0 Catalog No: AG005C8K MDL No:
Product Description
Catalog Number:
AG005C8K
Chemical Name:
1H-Indole-3-methanol, a-(aminomethyl)-5-methoxy-
CAS Number:
83053-23-0
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
IUPAC Name:
2-amino-1-(5-methoxy-1H-indol-3-yl)ethanol
InChI:
InChI=1S/C11H14N2O2/c1-15-7-2-3-10-8(4-7)9(6-13-10)11(14)5-12/h2-4,6,11,13-14H,5,12H2,1H3
InChI Key:
LXJQQNSPZRPXLY-UHFFFAOYSA-N
SMILES:
NCC(c1c[nH]c2c1cc(OC)cc2)O
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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