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Home > Boronic Acids > 936250-20-3
936250-20-3 | 3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazole
CAS No: 936250-20-3 Catalog No: AG006ETM MDL No:MFCD08690235
Product Description
Catalog Number:
AG006ETM
Chemical Name:
3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazole
CAS Number:
936250-20-3
Molecular Formula:
C10H17BN2O2
Molecular Weight:
208.0652
MDL Number:
MFCD08690235
IUPAC Name:
5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
InChI:
InChI=1S/C10H17BN2O2/c1-7-8(6-12-13-7)11-14-9(2,3)10(4,5)15-11/h6H,1-5H3,(H,12,13)
InChI Key:
MSJAEFFWTBMIKT-UHFFFAOYSA-N
SMILES:
Cc1n[nH]cc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.138g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.068g/mol
Monoisotopic Mass:
208.138g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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