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Home > Boronic Acids > 121021-24-7
121021-24-7 | Diisopropyl (3,3-dimethylbut-1-yn-1-yl)boronate
CAS No: 121021-24-7 Catalog No: AG003PJN MDL No:MFCD06411312
Product Description
Catalog Number:
AG003PJN
Chemical Name:
Diisopropyl (3,3-dimethylbut-1-yn-1-yl)boronate
CAS Number:
121021-24-7
Molecular Formula:
C12H23BO2
Molecular Weight:
210.1208
MDL Number:
MFCD06411312
IUPAC Name:
3,3-dimethylbut-1-ynyl-di(propan-2-yloxy)borane
InChI:
InChI=1S/C12H23BO2/c1-10(2)14-13(15-11(3)4)9-8-12(5,6)7/h10-11H,1-7H3
InChI Key:
FLHZJMZNIOCRSX-UHFFFAOYSA-N
SMILES:
CC(OB(OC(C)C)C#CC(C)(C)C)C
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.179g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.124g/mol
Monoisotopic Mass:
210.179g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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