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1190861-50-7

1190861-50-7 | 2',3',5',6'-TETRAHYDROSPIRO[INDOLINE-3,4'-PYRAN]-2-ONE-6-BORONIC ACID PINACOL ESTER

CAS No: 1190861-50-7 Catalog No: AG00979E MDL No:

Product Description

Catalog Number:
AG00979E
Chemical Name:
2',3',5',6'-TETRAHYDROSPIRO[INDOLINE-3,4'-PYRAN]-2-ONE-6-BORONIC ACID PINACOL ESTER
CAS Number:
1190861-50-7
IUPAC Name:
(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)borinic acid
InChI:
InChI=1S/C18H26BNO5/c1-16(2,22)17(3,4)25-19(23)12-5-6-13-14(11-12)20-15(21)18(13)7-9-24-10-8-18/h5-6,11,22-23H,7-10H2,1-4H3,(H,20,21)
InChI Key:
BOOGHYKANCWBQX-UHFFFAOYSA-N

Properties

Complexity:
518  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.19g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
347.218g/mol
Monoisotopic Mass:
347.19g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
88A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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