Benzoic acid, 4-nonyl-


Chemical Name: Benzoic acid, 4-nonyl-
CAS Number: 38289-46-2
Product Number: AG00C77O(AGN-PC-0JKPZU)
Synonyms:
MDL No:
Molecular Formula: C16H24O2
Molecular Weight: 248.3606

Identification/Properties


Computed Properties
Molecular Weight:
248.366g/mol
XLogP3:
6.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
9
Exact Mass:
248.178g/mol
Monoisotopic Mass:
248.178g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
217
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P264-P302+P352-P304+P340-P305+P351+P338-P332+P313-P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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