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165277-48-5 | Benzyl[1-(thiophen-2-yl)pentyl]amine
CAS No: 165277-48-5 Catalog No: AG01FDN1 MDL No:
Product Description
Catalog Number:
AG01FDN1
Chemical Name:
Benzyl[1-(thiophen-2-yl)pentyl]amine
CAS Number:
165277-48-5
Molecular Formula:
C16H21NS
Molecular Weight:
259.4096
IUPAC Name:
N-benzyl-1-thiophen-2-ylpentan-1-amine
InChI:
InChI=1S/C16H21NS/c1-2-3-10-15(16-11-7-12-18-16)17-13-14-8-5-4-6-9-14/h4-9,11-12,15,17H,2-3,10,13H2,1H3
InChI Key:
HAVZCXVHKKRSBZ-UHFFFAOYSA-N
SMILES:
CCCCC(c1cccs1)NCc1ccccc1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.139g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.411g/mol
Monoisotopic Mass:
259.139g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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