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Home > Boronic Acids > 850567-91-8
850567-91-8 | (4-(tert-Butyl)cyclohex-1-en-1-yl)boronic acid
CAS No: 850567-91-8 Catalog No: AG003BUD MDL No:MFCD06659856
Product Description
Catalog Number:
AG003BUD
Chemical Name:
(4-(tert-Butyl)cyclohex-1-en-1-yl)boronic acid
CAS Number:
850567-91-8
Molecular Formula:
C10H19BO2
Molecular Weight:
182.0677
MDL Number:
MFCD06659856
IUPAC Name:
(4-tert-butylcyclohexen-1-yl)boronic acid
InChI:
InChI=1S/C10H19BO2/c1-10(2,3)8-4-6-9(7-5-8)11(12)13/h6,8,12-13H,4-5,7H2,1-3H3
InChI Key:
QPJWLDFYBBQYSG-UHFFFAOYSA-N
SMILES:
OB(C1=CCC(CC1)C(C)(C)C)O
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.148g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.07g/mol
Monoisotopic Mass:
182.148g/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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