Home Boronic acids (2-methylbutyl)boronic acid

(2-methylbutyl)boronic acid

CAS No.:
444885-09-0
Catalog Number:
AG01B259
Molecular Formula:
C5H13BO2
Molecular Weight:
115.9665
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Product Description
Catalog Number:
AG01B259
Chemical Name:
(2-methylbutyl)boronic acid
CAS Number:
444885-09-0
Molecular Formula:
C5H13BO2
Molecular Weight:
115.9665
MDL Number:
MFCD18861700
IUPAC Name:
2-methylbutylboronic acid
InChI:
InChI=1S/C5H13BO2/c1-3-5(2)4-6(7)8/h5,7-8H,3-4H2,1-2H3
InChI Key:
NGHJHHWXNRSHSI-UHFFFAOYSA-N
SMILES:
CCC(CB(O)O)C
Properties
Complexity:
56.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.101g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
115.967g/mol
Monoisotopic Mass:
116.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties