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Home > Boronic Acids > 1227071-40-0
1227071-40-0 | (4-hydroxycyclohex-1-en-1-yl)boronic acid
CAS No: 1227071-40-0 Catalog No: AG00ISEG MDL No:MFCD22191958
Product Description
Catalog Number:
AG00ISEG
Chemical Name:
(4-hydroxycyclohex-1-en-1-yl)boronic acid
CAS Number:
1227071-40-0
Molecular Formula:
C6H11BO3
Molecular Weight:
141.9607
MDL Number:
MFCD22191958
IUPAC Name:
(4-hydroxycyclohexen-1-yl)boronic acid
InChI:
InChI=1S/C6H11BO3/c8-6-3-1-5(2-4-6)7(9)10/h1,6,8-10H,2-4H2
InChI Key:
DXDNJLOMTLODHR-UHFFFAOYSA-N
SMILES:
OC1CCC(=CC1)B(O)O
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.08g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
141.961g/mol
Monoisotopic Mass:
142.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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