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Home > Boronic Acids > 1221823-93-3

1221823-93-3

1221823-93-3 | Boronic acid, B-[4-[(cyclohexyloxy)methyl]phenyl]-

CAS No: 1221823-93-3 Catalog No: AG0016WD MDL No:MFCD16198473

Product Description

Catalog Number:
AG0016WD
Chemical Name:
Boronic acid, B-[4-[(cyclohexyloxy)methyl]phenyl]-
CAS Number:
1221823-93-3
Molecular Formula:
C13H19BO3
Molecular Weight:
234.0992
MDL Number:
MFCD16198473
IUPAC Name:
[4-(cyclohexyloxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C13H19BO3/c15-14(16)12-8-6-11(7-9-12)10-17-13-4-2-1-3-5-13/h6-9,13,15-16H,1-5,10H2
InChI Key:
KSJIFPBSHMFGOT-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)COC1CCCCC1)O

Properties

Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.143g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.102g/mol
Monoisotopic Mass:
234.143g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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