Home Halogens 7-(bromomethyl)-6-oxaspiro[3.4]octan-5-one

7-(bromomethyl)-6-oxaspiro[3.4]octan-5-one

CAS No.:
1803590-51-3
Catalog Number:
AG01BDCI
Molecular Formula:
C8H11BrO2
Molecular Weight:
219.0757
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Product Description
Catalog Number:
AG01BDCI
Chemical Name:
7-(bromomethyl)-6-oxaspiro[3.4]octan-5-one
CAS Number:
1803590-51-3
Molecular Formula:
C8H11BrO2
Molecular Weight:
219.0757
MDL Number:
MFCD28023682
IUPAC Name:
7-(bromomethyl)-6-oxaspiro[3.4]octan-5-one
InChI:
InChI=1S/C8H11BrO2/c9-5-6-4-8(2-1-3-8)7(10)11-6/h6H,1-5H2
InChI Key:
YCJYTTJFZUBJGC-UHFFFAOYSA-N
SMILES:
BrCC1OC(=O)C2(C1)CCC2
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.994g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.078g/mol
Monoisotopic Mass:
217.994g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties