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1704069-26-0

1704069-26-0 | (3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-(trifluoroMethoxy)phenyl)boronic acid

CAS No: 1704069-26-0 Catalog No: AG00AR8D MDL No:

Product Description

Catalog Number:
AG00AR8D
Chemical Name:
(3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-(trifluoroMethoxy)phenyl)boronic acid
CAS Number:
1704069-26-0
IUPAC Name:
[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C14H17BF3NO7S/c16-14(17,18)26-11-2-1-10(15(20)21)9-12(11)27(22,23)19-5-3-13(4-6-19)24-7-8-25-13/h1-2,9,20-21H,3-8H2
InChI Key:
VCZCDXRISXQMJU-UHFFFAOYSA-N

Properties

Complexity:
611  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
411.077g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
411.155g/mol
Monoisotopic Mass:
411.077g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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