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130419-61-3

130419-61-3 | Ethanol, 2-[2-(octadecenyloxy)ethoxy]-, dihydrogen phosphate (9CI)

CAS No: 130419-61-3 Catalog No: AG000UF1 MDL No:

Product Description

Catalog Number:
AG000UF1
Chemical Name:
Ethanol, 2-[2-(octadecenyloxy)ethoxy]-, dihydrogen phosphate (9CI)
CAS Number:
130419-61-3
Molecular Formula:
C22H47O6P
Molecular Weight:
438.5787
IUPAC Name:
dihydroxy(oxo)phosphanium;2-(2-octadec-1-enoxyethoxy)ethanol
InChI:
InChI=1S/C22H44O3.HO3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-24-21-22-25-20-18-23;1-4(2)3/h17,19,23H,2-16,18,20-22H2,1H3;(H-,1,2,3)/p+1
InChI Key:
ZLKCYDOCASSLLN-UHFFFAOYSA-O
SMILES:
OP(=O)O.CCCCCCCCCCCCCCCCC=COCCOCCO

Properties

Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
437.303g/mol
Formal Charge:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
437.578g/mol
Monoisotopic Mass:
437.303g/mol
Rotatable Bond Count:
21  
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  

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