Home Halogens tert-butyl 5-bromospiro[2H-indole-3,4'-oxane]-1-carboxylate

tert-butyl 5-bromospiro[2H-indole-3,4'-oxane]-1-carboxylate

CAS No.:
1445951-09-6
Catalog Number:
AG01DFVQ
Molecular Formula:
C17H22BrNO3
Molecular Weight:
368.2655
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Product Description
Catalog Number:
AG01DFVQ
Chemical Name:
tert-butyl 5-bromospiro[2H-indole-3,4'-oxane]-1-carboxylate
CAS Number:
1445951-09-6
Molecular Formula:
C17H22BrNO3
Molecular Weight:
368.2655
MDL Number:
MFCD25509343
IUPAC Name:
tert-butyl 5-bromospiro[2H-indole-3,4'-oxane]-1-carboxylate
InChI:
InChI=1S/C17H22BrNO3/c1-16(2,3)22-15(20)19-11-17(6-8-21-9-7-17)13-10-12(18)4-5-14(13)19/h4-5,10H,6-9,11H2,1-3H3
InChI Key:
LKYRVUIMASOGGH-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C1(CCOCC1)CN2C(=O)OC(C)(C)C
Properties
Complexity:
428  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.078g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.271g/mol
Monoisotopic Mass:
367.078g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties