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19781-43-2

19781-43-2 | 4-HEXADECANOL

CAS No: 19781-43-2 Catalog No: AG002B2L MDL No:

Product Description

Catalog Number:
AG002B2L
Chemical Name:
4-HEXADECANOL
CAS Number:
19781-43-2
Molecular Formula:
C16H34O
Molecular Weight:
242.4406
IUPAC Name:
hexadecan-4-ol
InChI:
InChI=1S/C16H34O/c1-3-5-6-7-8-9-10-11-12-13-15-16(17)14-4-2/h16-17H,3-15H2,1-2H3
InChI Key:
JIMMILCKVYOFET-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCC(CCC)O

Properties

Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.261g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.447g/mol
Monoisotopic Mass:
242.261g/mol
Rotatable Bond Count:
13  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
7  

Literature

Title Journal
Structure and organization of hexadecanol isomers adsorbed to the air/water interface. Langmuir : the ACS journal of surfaces and colloids 20060912

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