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140853-59-4 | 3-Benzofuranethanamine, 5-methoxy-α-methyl-
CAS No: 140853-59-4 Catalog No: AG001CWH MDL No:
Product Description
Catalog Number:
AG001CWH
Chemical Name:
3-Benzofuranethanamine, 5-methoxy-α-methyl-
CAS Number:
140853-59-4
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
IUPAC Name:
1-(5-methoxy-1-benzofuran-3-yl)propan-2-amine
InChI:
InChI=1S/C12H15NO2/c1-8(13)5-9-7-15-12-4-3-10(14-2)6-11(9)12/h3-4,6-8H,5,13H2,1-2H3
InChI Key:
PMAFEFSQHHKAKM-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(o2)CC(N)C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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