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Home > Boronic Acids > 1072945-73-3
1072945-73-3 | (3-(Cyclohexyl(methyl)carbamoyl)phenyl)boronic acid
CAS No: 1072945-73-3 Catalog No: AG007ESE MDL No:MFCD09972095
Product Description
Catalog Number:
AG007ESE
Chemical Name:
(3-(Cyclohexyl(methyl)carbamoyl)phenyl)boronic acid
CAS Number:
1072945-73-3
Molecular Formula:
C14H20BNO3
Molecular Weight:
261.1245
MDL Number:
MFCD09972095
IUPAC Name:
[3-[cyclohexyl(methyl)carbamoyl]phenyl]boronic acid
InChI:
InChI=1S/C14H20BNO3/c1-16(13-8-3-2-4-9-13)14(17)11-6-5-7-12(10-11)15(18)19/h5-7,10,13,18-19H,2-4,8-9H2,1H3
InChI Key:
MFWBKTUXYRRWCS-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1cccc(c1)B(O)O)C1CCCCC1
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.154g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.128g/mol
Monoisotopic Mass:
261.154g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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