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83091-49-0 | 2H-Pyran-3,4,5-triol, 2-decyltetrahydro-
CAS No: 83091-49-0 Catalog No: AG004WTL MDL No:
Product Description
Catalog Number:
AG004WTL
Chemical Name:
2H-Pyran-3,4,5-triol, 2-decyltetrahydro-
CAS Number:
83091-49-0
Molecular Formula:
C15H30O4
Molecular Weight:
274.3963
IUPAC Name:
2-decyloxane-3,4,5-triol
InChI:
InChI=1S/C15H30O4/c1-2-3-4-5-6-7-8-9-10-13-15(18)14(17)12(16)11-19-13/h12-18H,2-11H2,1H3
InChI Key:
UQROZQKQZKYQMO-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC1OCC(C(C1O)O)O
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.214g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
274.401g/mol
Monoisotopic Mass:
274.214g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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