B(C1=CC=CC=C1C2=NNN=N2)(O)O
CAS: 155884-01-8
Nom: [2-(2H-tetrazol-5-yl)phenyl]boronic acid
SMILES: B(C1=CC=CC=C1C2=NNN=N2)(O)O

Molecular Processing

Molecular formula
C7H7BN4O2
Molecular weight
189.97
Exact mass
190.0662
XLogP
-1.45
TPSA
94.92
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
49.44

Supplementary Information

InChIKey: GVRXWYFECKHTSJ-UHFFFAOYSA-N
Synonymes
2-(Tetrazol-5-yl)phenylboronic acidRefChem:462367686-953-9155884-01-8(2-(1H-Tetrazol-5-yl)phenyl)boronic acid2-(5-Tetrazolyl)phenylboronic acid2-(2H-tetrazol-5-yl)-phenylboronic acid[2-(2H-tetrazol-5-yl)phenyl]boronic Acid2-(1H-Tetrazol-5-yl)phenylboronic acid2-(2H-Tetrazol-5-yl)phenylboronic acidBoronic acid, B-[2-(2H-tetrazol-5-yl)phenyl]-MFCD06796325[2-(1H-1,2,3,4-tetrazol-5-yl)phenyl]boronic acid(2-(2H-tetrazol-5-yl)phenyl)boronic acidBoronic acid, [2-(1H-tetrazol-5-yl)phenyl]-2-(5-Tetrazolyl)phenylboronicAcid2-tetrazolylphenylboronic acidSCHEMBL498018SCHEMBL2444997SCHEMBL29465615SCHEMBL29953742DTXSID70457562GVRXWYFECKHTSJ-UHFFFAOYSA-NAKOS006281424AKOS015854409AB07953CS-W0008772-(1H-tetrazole-5-yl)phenylboronic acidDS-18268SY026022
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Impliqué dans 4 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→