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14773-42-3 | Benzenepropanamine, 3,4-dimethoxy-
CAS No: 14773-42-3 Catalog No: AG001F69 MDL No:MFCD01175160
Product Description
Catalog Number:
AG001F69
Chemical Name:
Benzenepropanamine, 3,4-dimethoxy-
CAS Number:
14773-42-3
Molecular Formula:
C11H17NO2
Molecular Weight:
195.2582
MDL Number:
MFCD01175160
IUPAC Name:
3-(3,4-dimethoxyphenyl)propan-1-amine
InChI:
InChI=1S/C11H17NO2/c1-13-10-6-5-9(4-3-7-12)8-11(10)14-2/h5-6,8H,3-4,7,12H2,1-2H3
InChI Key:
WYYQSKUMIFPNFW-UHFFFAOYSA-N
SMILES:
NCCCc1ccc(c(c1)OC)OC
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.262g/mol
Monoisotopic Mass:
195.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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