B(C1=CC=C(C=C1)OCC2=CC=CC=C2)(O)O
CAS: 146631-00-7
Name: (4-phenylmethoxyphenyl)boronic acid
SMILES: B(C1=CC=C(C=C1)OCC2=CC=CC=C2)(O)O

Molecular Processing

Molecular formula
C13H13BO3
Molecular weight
228.06
Exact mass
228.0958
XLogP
0.95
TPSA
49.69
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
67.04

Supplementary Information

InChIKey: DMJHEIDWSIAXCS-UHFFFAOYSA-N
Synonyme
4-Benzyloxy-phenylboronic acidRefChem:518533678-070-24-Benzyloxyphenylboronic acid146631-00-74-Benzyloxybenzeneboronic Acid(4-(Benzyloxy)phenyl)boronic acid4-(Benzyloxy)phenylboronic acid[4-(benzyloxy)phenyl]boronic acid(4-phenylmethoxyphenyl)boronic AcidMFCD01075705CHEMBL1824170(4-(Benzyloxy)phenyl)boronic acid;4-Benzyloxyphenylboronic acidBoronic acid, [4-(phenylmethoxy)phenyl]-(4-benzyloxyphenyl)boronic acid[4-(Phenylmethoxy)phenyl]boronic Acid; 4-(Benzyloxy)benzeneboronic Acid;4-benzoxyphenylboronic acidSCHEMBL1426654-Benzyloxyphenyl boronic acid4-benzyloxybenzene boronic acidorb2940008(4-Benzyloxybenzene)boronic acid4-benzyloxy benzene boronic acidDTXSID503702054-(phenylmethoxy)phenylboronic acid[4-(Benzyloxy)phenyl]-boronic acid4-(phenylmethoxy)benzeneboronic acidBDBM50615762EBC-03758SBB063447
Quelle anzeigen →
An 503 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→