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Home Other Building Blocks 1,4-Pentanediol

1,4-Pentanediol

CAS No.:
626-95-9
Catalog Number:
AG0038KY
Molecular Formula:
C5H12O2
Molecular Weight:
104.1476
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$181
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Product Description
Catalog Number:
AG0038KY
Chemical Name:
1,4-Pentanediol
CAS Number:
626-95-9
Molecular Formula:
C5H12O2
Molecular Weight:
104.1476
MDL Number:
MFCD00004560
IUPAC Name:
pentane-1,4-diol
InChI:
InChI=1S/C5H12O2/c1-5(7)3-2-4-6/h5-7H,2-4H2,1H3
InChI Key:
GLOBUAZSRIOKLN-UHFFFAOYSA-N
SMILES:
OCCCC(O)C
EC Number:
210-973-5
Properties
Complexity:
37.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.084g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
104.149g/mol
Monoisotopic Mass:
104.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
Experimental H-type bovine spongiform encephalopathy characterized by plaques and glial- and stellate-type prion protein deposits. Veterinary research 20110101
An alternative route for the synthesis of silicon nanowires via porous anodic alumina masks. Nanoscale research letters 20110101
Solvation of the amphiphilic diol molecule in aliphatic alcohol-water and fluorinated alcohol-water solutions. The journal of physical chemistry. B 20100401
Metal-Based Antibacterial and Antifungal Agents: Synthesis, Characterization, and In Vitro Biological Evaluation of Co(II), Cu(II), Ni(II), and Zn(II) Complexes With Amino Acid-Derived Compounds. Bioinorganic chemistry and applications 20060101
Micellar cobaltporphyrin nanorods in alcohols. Journal of the American Chemical Society 20040915
Properties