Home Halogens 1,4-Dioxaspiro[4.4]nonane,2-(chloromethyl)-

1,4-Dioxaspiro[4.4]nonane,2-(chloromethyl)-

CAS No.:
22195-53-5
Catalog Number:
AG006ZGL
Molecular Formula:
C8H13ClO2
Molecular Weight:
176.6406
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Product Description
Catalog Number:
AG006ZGL
Chemical Name:
1,4-Dioxaspiro[4.4]nonane,2-(chloromethyl)-
CAS Number:
22195-53-5
Molecular Formula:
C8H13ClO2
Molecular Weight:
176.6406
MDL Number:
MFCD02975829
IUPAC Name:
3-(chloromethyl)-1,4-dioxaspiro[4.4]nonane
InChI:
InChI=1S/C8H13ClO2/c9-5-7-6-10-8(11-7)3-1-2-4-8/h7H,1-6H2
InChI Key:
YIFKYXFYLABVBB-UHFFFAOYSA-N
SMILES:
ClCC1COC2(O1)CCCC2
NSC Number:
41992
Properties
Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.06g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.64g/mol
Monoisotopic Mass:
176.06g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties