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126422-58-0 | 4,7,10,13-Tetraoxahexadeca-1,15-diyne
CAS No: 126422-58-0 Catalog No: AG000SRZ MDL No:MFCD22683298
Product Description
Catalog Number:
AG000SRZ
Chemical Name:
4,7,10,13-Tetraoxahexadeca-1,15-diyne
CAS Number:
126422-58-0
Molecular Formula:
C12H18O4
Molecular Weight:
226.2689
MDL Number:
MFCD22683298
IUPAC Name:
3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-yne
InChI:
InChI=1S/C12H18O4/c1-3-5-13-7-9-15-11-12-16-10-8-14-6-4-2/h1-2H,5-12H2
InChI Key:
PHRQSGRBGBTBAD-UHFFFAOYSA-N
SMILES:
C#CCOCCOCCOCCOCC#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:
-0.1
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