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Home > Boronic Acids > 1072946-31-6
1072946-31-6 | (4-Pentylcyclohex-1-en-1-yl)boronic acid
CAS No: 1072946-31-6 Catalog No: AG003BWM MDL No:MFCD10699637
Product Description
Catalog Number:
AG003BWM
Chemical Name:
(4-Pentylcyclohex-1-en-1-yl)boronic acid
CAS Number:
1072946-31-6
Molecular Formula:
C11H21BO2
Molecular Weight:
196.0942
MDL Number:
MFCD10699637
IUPAC Name:
(4-pentylcyclohexen-1-yl)boronic acid
InChI:
InChI=1S/C11H21BO2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h8,10,13-14H,2-7,9H2,1H3
InChI Key:
FNIVZIHUKLFDQI-UHFFFAOYSA-N
SMILES:
CCCCCC1CCC(=CC1)B(O)O
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.163g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.097g/mol
Monoisotopic Mass:
196.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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