200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 847818-58-0
847818-58-0 | (1-Isopentyl-1H-pyrazol-4-yl)boronic acid
CAS No: 847818-58-0 Catalog No: AG003BFK MDL No:MFCD07781209
Product Description
Catalog Number:
AG003BFK
Chemical Name:
(1-Isopentyl-1H-pyrazol-4-yl)boronic acid
CAS Number:
847818-58-0
Molecular Formula:
C8H15BN2O2
Molecular Weight:
182.0279
MDL Number:
MFCD07781209
IUPAC Name:
[1-(3-methylbutyl)pyrazol-4-yl]boronic acid
InChI:
InChI=1S/C8H15BN2O2/c1-7(2)3-4-11-6-8(5-10-11)9(12)13/h5-7,12-13H,3-4H2,1-2H3
InChI Key:
RFMLXEBQNNMUHX-UHFFFAOYSA-N
SMILES:
OB(c1cnn(c1)CCC(C)C)O
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.123g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.03g/mol
Monoisotopic Mass:
182.123g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.