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Home > Boronic Acids > 88496-88-2
88496-88-2 | sec-Butylboronic acid
CAS No: 88496-88-2 Catalog No: AG0034KK MDL No:MFCD06656265
Product Description
Catalog Number:
AG0034KK
Chemical Name:
sec-Butylboronic acid
CAS Number:
88496-88-2
Molecular Formula:
C4H11BO2
Molecular Weight:
101.9399
MDL Number:
MFCD06656265
IUPAC Name:
butan-2-ylboronic acid
InChI:
InChI=1S/C4H11BO2/c1-3-4(2)5(6)7/h4,6-7H,3H2,1-2H3
InChI Key:
MACOIFNUPFKZEI-UHFFFAOYSA-N
SMILES:
CCC(B(O)O)C
Properties
Complexity:
47
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
102.085g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
101.94g/mol
Monoisotopic Mass:
102.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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