1,13-Tridecanediol


Chemical Name: 1,13-Tridecanediol
CAS Number: 13362-52-2
Product Number: AG003853(AGN-PC-0NFA3V)
Synonyms:
MDL No:
Molecular Formula: C13H28O2
Molecular Weight: 216.3602

Identification/Properties


Computed Properties
Molecular Weight:
216.365g/mol
XLogP3:
4.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
12
Exact Mass:
216.209g/mol
Monoisotopic Mass:
216.209g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
92.7
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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