Home Other Building Blocks Octanoic acid, 2-ethyl-

Octanoic acid, 2-ethyl-

CAS No.:
25234-25-7
Catalog Number:
AG007O0T
Molecular Formula:
C10H20O2
Molecular Weight:
172.2646
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Product Description
Catalog Number:
AG007O0T
Chemical Name:
Octanoic acid, 2-ethyl-
CAS Number:
25234-25-7
Molecular Formula:
C10H20O2
Molecular Weight:
172.2646
MDL Number:
MFCD02258649
IUPAC Name:
2-ethyloctanoic acid
InChI:
InChI=1S/C10H20O2/c1-3-5-6-7-8-9(4-2)10(11)12/h9H,3-8H2,1-2H3,(H,11,12)
InChI Key:
DMUXSGAKEXSNGN-UHFFFAOYSA-N
SMILES:
CCCCCCC(C(=O)O)CC
EC Number:
246-743-6
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.146g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.268g/mol
Monoisotopic Mass:
172.146g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
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Properties