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61501-06-2

61501-06-2 | D-glucofuranose cyclic 1,2-3,5 bis(butylboronate)-6-acetate

CAS No: 61501-06-2 Catalog No: AG00ESJM MDL No:

Product Description

Catalog Number:
AG00ESJM
Chemical Name:
D-glucofuranose cyclic 1,2-3,5 bis(butylboronate)-6-acetate
CAS Number:
61501-06-2
IUPAC Name:
[(1R,2R,6S,8R,9R)-4,11-dibutyl-3,5,7,10,12-pentaoxa-4,11-diboratricyclo[6.4.0.02,6]dodecan-9-yl]methyl acetate
InChI:
InChI=1S/C16H28B2O7/c1-4-6-8-17-22-12(10-20-11(3)19)13-14(23-17)15-16(21-13)25-18(24-15)9-7-5-2/h12-16H,4-10H2,1-3H3/t12-,13-,14+,15-,16-/m1/s1
InChI Key:
TXBZEVONGNOEQC-IBEHDNSVSA-N

Properties

Complexity:
452  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
354.202g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.013g/mol
Monoisotopic Mass:
354.202g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Application of the combination of isotope ratio monitoring with isotope dilution mass spectrometry to the determination of glucose in serum. Rapid communications in mass spectrometry : RCM 20010101

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