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Home > Boronic Acids > 1627933-42-9
1627933-42-9 | 1,4-DIMETHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-1,2,3-TRI+
CAS No: 1627933-42-9 Catalog No: AG01C9FJ MDL No:MFCD13190025
Product Description
Catalog Number:
AG01C9FJ
Chemical Name:
1,4-DIMETHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-1,2,3-TRI+
CAS Number:
1627933-42-9
Molecular Formula:
C10H18BN3O2
Molecular Weight:
223.0798
MDL Number:
MFCD13190025
IUPAC Name:
1,4-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)triazole
InChI:
InChI=1S/C10H18BN3O2/c1-7-8(14(6)13-12-7)11-15-9(2,3)10(4,5)16-11/h1-6H3
InChI Key:
CJXUJFWHQHUFPQ-UHFFFAOYSA-N
SMILES:
Cc1nnn(c1B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.149g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.083g/mol
Monoisotopic Mass:
223.149g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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