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869942-06-3 | (2-ETHOXYBENZYL)ETHYLAMINE
CAS No: 869942-06-3 Catalog No: AG004KEI MDL No:MFCD04588387
Product Description
Catalog Number:
AG004KEI
Chemical Name:
(2-ETHOXYBENZYL)ETHYLAMINE
CAS Number:
869942-06-3
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD04588387
IUPAC Name:
N-[(2-ethoxyphenyl)methyl]ethanamine
InChI:
InChI=1S/C11H17NO/c1-3-12-9-10-7-5-6-8-11(10)13-4-2/h5-8,12H,3-4,9H2,1-2H3
InChI Key:
QKWSPHNCLTZVOR-UHFFFAOYSA-N
SMILES:
NCCCc1ccccc1OCC
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:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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