Home Other Building Blocks 5-BROMO-3-(1,4-DIOXASPIRO[4.5]DEC-7-EN-8-YL)-1H-INDOLE

5-BROMO-3-(1,4-DIOXASPIRO[4.5]DEC-7-EN-8-YL)-1H-INDOLE

CAS No.:
282546-99-0
Catalog Number:
AG00BH0W
Molecular Formula:
C16H16BrNO2
Molecular Weight:
334.2077
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Product Description
Catalog Number:
AG00BH0W
Chemical Name:
5-BROMO-3-(1,4-DIOXASPIRO[4.5]DEC-7-EN-8-YL)-1H-INDOLE
CAS Number:
282546-99-0
Molecular Formula:
C16H16BrNO2
Molecular Weight:
334.2077
MDL Number:
MFCD06411613
IUPAC Name:
5-bromo-3-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)-1H-indole
InChI:
InChI=1S/C16H16BrNO2/c17-12-1-2-15-13(9-12)14(10-18-15)11-3-5-16(6-4-11)19-7-8-20-16/h1-3,9-10,18H,4-8H2
InChI Key:
ZGKVTJQGVWHCDH-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(c[nH]2)C1=CCC2(CC1)OCCO2
Properties
Complexity:
405  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.036g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
334.213g/mol
Monoisotopic Mass:
333.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties