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893581-95-8 | (3-ETHOXYBENZYL)ETHYLAMINE
CAS No: 893581-95-8 Catalog No: AG003Z7K MDL No:MFCD07405847
Product Description
Catalog Number:
AG003Z7K
Chemical Name:
(3-ETHOXYBENZYL)ETHYLAMINE
CAS Number:
893581-95-8
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD07405847
IUPAC Name:
3-(3-ethoxyphenyl)propan-1-amine
InChI:
InChI=1S/C11H17NO/c1-2-13-11-7-3-5-10(9-11)6-4-8-12/h3,5,7,9H,2,4,6,8,12H2,1H3
InChI Key:
JUPFPMFGMFERHU-UHFFFAOYSA-N
SMILES:
NCCCc1cccc(c1)OCC
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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