Home Other Building Blocks 1,3-Propanediol, 2,2-dibutyl-

1,3-Propanediol, 2,2-dibutyl-

CAS No.:
24765-57-9
Catalog Number:
AG002PD8
Molecular Formula:
C11H24O2
Molecular Weight:
188.3071
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Product Description
Catalog Number:
AG002PD8
Chemical Name:
1,3-Propanediol, 2,2-dibutyl-
CAS Number:
24765-57-9
Molecular Formula:
C11H24O2
Molecular Weight:
188.3071
MDL Number:
MFCD01863725
IUPAC Name:
2,2-dibutylpropane-1,3-diol
InChI:
InChI=1S/C11H24O2/c1-3-5-7-11(9-12,10-13)8-6-4-2/h12-13H,3-10H2,1-2H3
InChI Key:
OJMJOSRCBAXSAQ-UHFFFAOYSA-N
SMILES:
CCCCC(CCCC)(CO)CO
Properties
Complexity:
98.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.178g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
188.311g/mol
Monoisotopic Mass:
188.178g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties