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88071-15-2 | 4,6,11,13-Tetraoxahexadeca-1,15-diyne
CAS No: 88071-15-2 Catalog No: AG004HWF MDL No:
Product Description
Catalog Number:
AG004HWF
Chemical Name:
4,6,11,13-Tetraoxahexadeca-1,15-diyne
CAS Number:
88071-15-2
Molecular Formula:
C12H18O4
Molecular Weight:
226.2689
IUPAC Name:
1,4-bis(prop-2-ynoxymethoxy)butane
InChI:
InChI=1S/C12H18O4/c1-3-7-13-11-15-9-5-6-10-16-12-14-8-4-2/h1-2H,5-12H2
InChI Key:
KYCZJQIDJDQIPZ-UHFFFAOYSA-N
SMILES:
C#CCOCOCCCCOCOCC#C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.272g/mol
Monoisotopic Mass:
226.121g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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