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15806-29-8

15806-29-8 | Benzeneethanamine, 2,4-dimethoxy-

CAS No: 15806-29-8 Catalog No: AG001PY6 MDL No:MFCD13193782

Product Description

Catalog Number:
AG001PY6
Chemical Name:
Benzeneethanamine, 2,4-dimethoxy-
CAS Number:
15806-29-8
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
MDL Number:
MFCD13193782
IUPAC Name:
2-(2,4-dimethoxyphenyl)ethanamine
InChI:
InChI=1S/C10H15NO2/c1-12-9-4-3-8(5-6-11)10(7-9)13-2/h3-4,7H,5-6,11H2,1-2H3
InChI Key:
YDTQAPOROITHCN-UHFFFAOYSA-N
SMILES:
NCCc1ccc(cc1OC)OC

Properties

Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.11g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.235g/mol
Monoisotopic Mass:
181.11g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Literature

Title Journal
A submarine journey: the pyrrole-imidazole alkaloids. Marine drugs 20091201

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