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88595-20-4

88595-20-4 | 1-Pentanol, 5-(octyloxy)-

CAS No: 88595-20-4 Catalog No: AG004B38 MDL No:

Product Description

Catalog Number:
AG004B38
Chemical Name:
1-Pentanol, 5-(octyloxy)-
CAS Number:
88595-20-4
Molecular Formula:
C13H28O2
Molecular Weight:
216.3602
IUPAC Name:
5-octoxypentan-1-ol
InChI:
InChI=1S/C13H28O2/c1-2-3-4-5-6-9-12-15-13-10-7-8-11-14/h14H,2-13H2,1H3
InChI Key:
VUAUIQVVYMXLND-UHFFFAOYSA-N
SMILES:
CCCCCCCCOCCCCCO

Properties

Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.209g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.365g/mol
Monoisotopic Mass:
216.209g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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