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308818-12-4

308818-12-4 | 1,3-Dioxan-5-ol, 2-methyl-2-undecyl-

CAS No: 308818-12-4 Catalog No: AG0031KE MDL No:

Product Description

Catalog Number:
AG0031KE
Chemical Name:
1,3-Dioxan-5-ol, 2-methyl-2-undecyl-
CAS Number:
308818-12-4
Molecular Formula:
C16H32O3
Molecular Weight:
272.4235
IUPAC Name:
2-methyl-2-undecyl-1,3-dioxan-5-ol
InChI:
InChI=1S/C16H32O3/c1-3-4-5-6-7-8-9-10-11-12-16(2)18-13-15(17)14-19-16/h15,17H,3-14H2,1-2H3
InChI Key:
MXIPRCUFDSPZEV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC1(C)OCC(CO1)O

Properties

Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.235g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.429g/mol
Monoisotopic Mass:
272.235g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  

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