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18796-04-8

18796-04-8 | 1H-Imidazol-1-yloxy, 2,5-dihydro-2,2,4,5,5-pentamethyl-, 3-oxide

CAS No: 18796-04-8 Catalog No: AG002GLD MDL No:

Product Description

Catalog Number:
AG002GLD
Chemical Name:
1H-Imidazol-1-yloxy, 2,5-dihydro-2,2,4,5,5-pentamethyl-, 3-oxide
CAS Number:
18796-04-8
Molecular Formula:
C9H18Cl2O4
Molecular Weight:
261.1428
IUPAC Name:
1-chloro-3-[2-(3-chloro-2-hydroxypropoxy)propoxy]propan-2-ol
InChI:
InChI=1S/C9H18Cl2O4/c1-7(15-6-9(13)3-11)4-14-5-8(12)2-10/h7-9,12-13H,2-6H2,1H3
InChI Key:
DOCLYKIGBJGQFA-UHFFFAOYSA-N
SMILES:
ClCC(COCC(OCC(CCl)O)C)O

Properties

Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.058g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.139g/mol
Monoisotopic Mass:
260.058g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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