Home Other Building Blocks 4-Octanol, 4,7-dimethyl-

4-Octanol, 4,7-dimethyl-

CAS No.:
19781-13-6
Catalog Number:
AG002B2V
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
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Product Description
Catalog Number:
AG002B2V
Chemical Name:
4-Octanol, 4,7-dimethyl-
CAS Number:
19781-13-6
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
MDL Number:
MFCD00046603
IUPAC Name:
4,7-dimethyloctan-4-ol
InChI:
InChI=1S/C10H22O/c1-5-7-10(4,11)8-6-9(2)3/h9,11H,5-8H2,1-4H3
InChI Key:
OTISWHNJCUMBFI-UHFFFAOYSA-N
SMILES:
CCCC(CCC(C)C)(O)C
EC Number:
243-306-1
Properties
Complexity:
99  
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:
5  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties