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Home > Boronic Acids > 140614-19-3
140614-19-3 | Boronic acid, (2-ethylbutyl)- (9CI)
CAS No: 140614-19-3 Catalog No: AG001CK7 MDL No:MFCD22190244
Product Description
Catalog Number:
AG001CK7
Chemical Name:
Boronic acid, (2-ethylbutyl)- (9CI)
CAS Number:
140614-19-3
Molecular Formula:
C6H15BO2
Molecular Weight:
129.9931
MDL Number:
MFCD22190244
IUPAC Name:
2-ethylbutylboronic acid
InChI:
InChI=1S/C6H15BO2/c1-3-6(4-2)5-7(8)9/h6,8-9H,3-5H2,1-2H3
InChI Key:
TYRRNCPGNQLJQH-UHFFFAOYSA-N
SMILES:
CCC(CB(O)O)CC
Properties
Complexity:
62.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.117g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
129.994g/mol
Monoisotopic Mass:
130.117g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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