Octanoic acid, 7-hydroxy-


Chemical Name: Octanoic acid, 7-hydroxy-
CAS Number: 17173-14-7
Product Number: AG00B3EK(AGN-PC-0JPPW9)
Synonyms:
MDL No:
Molecular Formula: C8H16O3
Molecular Weight: 160.2108

Identification/Properties


Computed Properties
Molecular Weight:
160.213g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
160.11g/mol
Monoisotopic Mass:
160.11g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
112
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
Danger
UN#:
3261
Hazard Statements:
H302-H314
Precautionary Statements:
P261-P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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