Home Other Building Blocks 2,2-Diethyl-1,3-propanediol

2,2-Diethyl-1,3-propanediol

CAS No.:
115-76-4
Catalog Number:
AG000FKJ
Molecular Formula:
C7H16O2
Molecular Weight:
132.2007
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50g
98%
In Stock USA
United States
$79
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Product Description
Catalog Number:
AG000FKJ
Chemical Name:
2,2-Diethyl-1,3-propanediol
CAS Number:
115-76-4
Molecular Formula:
C7H16O2
Molecular Weight:
132.2007
MDL Number:
MFCD00004695
IUPAC Name:
2,2-diethylpropane-1,3-diol
InChI:
InChI=1S/C7H16O2/c1-3-7(4-2,5-8)6-9/h8-9H,3-6H2,1-2H3
InChI Key:
XRVCFZPJAHWYTB-UHFFFAOYSA-N
SMILES:
CCC(CO)(CO)CC
EC Number:
204-103-3
UNII:
A40PF8120T
Properties
Complexity:
61.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.115g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
132.203g/mol
Monoisotopic Mass:
132.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties