Home Other Building Blocks 3-Octanol, 4-ethyl-

3-Octanol, 4-ethyl-

CAS No.:
19781-26-1
Catalog Number:
AG002B2R
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
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Product Description
Catalog Number:
AG002B2R
Chemical Name:
3-Octanol, 4-ethyl-
CAS Number:
19781-26-1
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
IUPAC Name:
4-ethyloctan-3-ol
InChI:
InChI=1S/C10H22O/c1-4-7-8-9(5-2)10(11)6-3/h9-11H,4-8H2,1-3H3
InChI Key:
VXSHGJKAEKIELL-UHFFFAOYSA-N
SMILES:
CCCCC(C(CC)O)CC
Properties
Complexity:
80.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.167g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.285g/mol
Monoisotopic Mass:
158.167g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties