Home Other Building Blocks 1-(7-methoxy-3,5-dimethyl-1-benzofuran-2-yl)ethan-1-amine

1-(7-methoxy-3,5-dimethyl-1-benzofuran-2-yl)ethan-1-amine

CAS No.:
1094254-09-7
Catalog Number:
AG019SNM
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
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Product Description
Catalog Number:
AG019SNM
Chemical Name:
1-(7-methoxy-3,5-dimethyl-1-benzofuran-2-yl)ethan-1-amine
CAS Number:
1094254-09-7
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
MDL Number:
MFCD11207657
IUPAC Name:
1-(7-methoxy-3,5-dimethyl-1-benzofuran-2-yl)ethanamine
InChI:
InChI=1S/C13H17NO2/c1-7-5-10-8(2)12(9(3)14)16-13(10)11(6-7)15-4/h5-6,9H,14H2,1-4H3
InChI Key:
NRWJAVNWMGAIQX-UHFFFAOYSA-N
SMILES:
COc1cc(C)cc2c1oc(c2C)C(N)C
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.284g/mol
Monoisotopic Mass:
219.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties