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206761-83-3 | [1,1'-Biphenyl]-3-amine, 4-(pentyloxy)-
CAS No: 206761-83-3 Catalog No: AG002IOK MDL No:MFCD00270119
Product Description
Catalog Number:
AG002IOK
Chemical Name:
[1,1'-Biphenyl]-3-amine, 4-(pentyloxy)-
CAS Number:
206761-83-3
Molecular Formula:
C17H21NO
Molecular Weight:
255.3547
MDL Number:
MFCD00270119
IUPAC Name:
2-pentoxy-5-phenylaniline
InChI:
InChI=1S/C17H21NO/c1-2-3-7-12-19-17-11-10-15(13-16(17)18)14-8-5-4-6-9-14/h4-6,8-11,13H,2-3,7,12,18H2,1H3
InChI Key:
AMXKEKVPPZQNHN-UHFFFAOYSA-N
SMILES:
CCCCCOc1ccc(cc1N)c1ccccc1
Properties
Complexity:
237
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:
4.6
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