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89807-70-5 | Benzenamine, 3-[3-(4-ethoxyphenyl)propyl]-
CAS No: 89807-70-5 Catalog No: AG003Y9W MDL No:
Product Description
Catalog Number:
AG003Y9W
Chemical Name:
Benzenamine, 3-[3-(4-ethoxyphenyl)propyl]-
CAS Number:
89807-70-5
Molecular Formula:
C17H21NO
Molecular Weight:
255.3547
IUPAC Name:
3-[3-(4-ethoxyphenyl)propyl]aniline
InChI:
InChI=1S/C17H21NO/c1-2-19-17-11-9-14(10-12-17)5-3-6-15-7-4-8-16(18)13-15/h4,7-13H,2-3,5-6,18H2,1H3
InChI Key:
IWYSLEVUQOKISB-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)CCCc1cccc(c1)N
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.162g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.361g/mol
Monoisotopic Mass:
255.162g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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