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864774-69-6

864774-69-6 | 3-Ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-indazole

CAS No: 864774-69-6 Catalog No: AG008G2D MDL No:MFCD11044599

Product Description

Catalog Number:
AG008G2D
Chemical Name:
3-Ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-indazole
CAS Number:
864774-69-6
Molecular Formula:
C15H21BN2O2
Molecular Weight:
272.1504
MDL Number:
MFCD11044599
IUPAC Name:
3-ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-indazole
InChI:
InChI=1S/C15H21BN2O2/c1-6-12-11-9-10(7-8-13(11)18-17-12)16-19-14(2,3)15(4,5)20-16/h7-9H,6H2,1-5H3,(H,17,18)
InChI Key:
QTQOMKBLCGMCNK-UHFFFAOYSA-N
SMILES:
CCc1n[nH]c2c1cc(cc2)B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.17g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.155g/mol
Monoisotopic Mass:
272.17g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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