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24892-56-6 | 2,4-Decanediol
CAS No: 24892-56-6 Catalog No: AG002PRS MDL No:
Product Description
Catalog Number:
AG002PRS
Chemical Name:
2,4-Decanediol
CAS Number:
24892-56-6
Molecular Formula:
C10H22O2
Molecular Weight:
174.2805
IUPAC Name:
decane-2,4-diol
InChI:
InChI=1S/C10H22O2/c1-3-4-5-6-7-10(12)8-9(2)11/h9-12H,3-8H2,1-2H3
InChI Key:
AMJXRWSHIASCAM-UHFFFAOYSA-N
SMILES:
CCCCCCC(CC(O)C)O
NSC Number:
71570
Properties
Complexity:
93.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.162g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
174.284g/mol
Monoisotopic Mass:
174.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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