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Home > Boronic Acids > 127611-65-8
127611-65-8 | Boronic acid, B-[(1Z)-2-bromo-1-hexen-1-yl]-, bis(1-methylethyl) ester
CAS No: 127611-65-8 Catalog No: AG000X8E MDL No:
Product Description
Catalog Number:
AG000X8E
Chemical Name:
Boronic acid, B-[(1Z)-2-bromo-1-hexen-1-yl]-, bis(1-methylethyl) ester
CAS Number:
127611-65-8
Molecular Formula:
C12H24BBrO2
Molecular Weight:
291.0328
IUPAC Name:
2-bromohex-1-enyl-di(propan-2-yloxy)borane
InChI:
InChI=1S/C12H24BBrO2/c1-6-7-8-12(14)9-13(15-10(2)3)16-11(4)5/h9-11H,6-8H2,1-5H3
InChI Key:
QOZLMXMXQYNSDF-UHFFFAOYSA-N
SMILES:
CCCC/C(=C/B(OC(C)C)OC(C)C)/Br
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.036g/mol
Monoisotopic Mass:
290.105g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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