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Home Halogens tert-Butyl 6-bromo-4-oxospiro[chroman-2,4'-piperidine]-1'-carboxylate

tert-Butyl 6-bromo-4-oxospiro[chroman-2,4'-piperidine]-1'-carboxylate

CAS No.:
690632-38-3
Catalog Number:
AG006DJH
Molecular Formula:
C18H22BrNO4
Molecular Weight:
396.2756
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$61
- +
250mg
98%
In Stock USA
United States
$100
- +
1g
95%
In Stock USA
United States
$219
- +
5g
98%
In Stock USA
United States
$594
- +
Product Description
Catalog Number:
AG006DJH
Chemical Name:
tert-Butyl 6-bromo-4-oxospiro[chroman-2,4'-piperidine]-1'-carboxylate
CAS Number:
690632-38-3
Molecular Formula:
C18H22BrNO4
Molecular Weight:
396.2756
MDL Number:
MFCD05865132
IUPAC Name:
tert-butyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate
InChI:
InChI=1S/C18H22BrNO4/c1-17(2,3)24-16(22)20-8-6-18(7-9-20)11-14(21)13-10-12(19)4-5-15(13)23-18/h4-5,10H,6-9,11H2,1-3H3
InChI Key:
ZUKYLVHOLKDNGX-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(=O)CC1(O2)CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
508  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.073g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.281g/mol
Monoisotopic Mass:
395.073g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties