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Home > Boronic Acids > 1256346-34-5
1256346-34-5 | Boronic acid, B-(4-propyl-1-cyclohexen-1-yl)-
CAS No: 1256346-34-5 Catalog No: AG000O2E MDL No:MFCD16295083
Product Description
Catalog Number:
AG000O2E
Chemical Name:
Boronic acid, B-(4-propyl-1-cyclohexen-1-yl)-
CAS Number:
1256346-34-5
Molecular Formula:
C9H17BO2
Molecular Weight:
168.0411
MDL Number:
MFCD16295083
IUPAC Name:
(4-propylcyclohexen-1-yl)boronic acid
InChI:
InChI=1S/C9H17BO2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h6,8,11-12H,2-5,7H2,1H3
InChI Key:
NDHAAOSCMLXKIR-UHFFFAOYSA-N
SMILES:
CCCC1CCC(=CC1)B(O)O
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.132g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.043g/mol
Monoisotopic Mass:
168.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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