B(C1=CC=C(C=C1)CCBr)(O)O
CAS: 137756-90-2
이름: [4-(2-bromoethyl)phenyl]boronic acid
SMILES: B(C1=CC=C(C=C1)CCBr)(O)O

Molecular Processing

Molecular formula
C8H10BBrO2
Molecular weight
228.88
Exact mass
227.9957
XLogP
0.3
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
53.77

Supplementary Information

InChIKey: FFNGHXMQOMKXOW-UHFFFAOYSA-N
동의어
137756-90-24-(2-Bromoethyl)phenylboronic acid(4-(2-Bromoethyl)phenyl)boronic acid[4-(2-Bromoethyl)phenyl]boronic acidMFCD12546453Boronic acid, [4-(2-bromoethyl)phenyl]- (9CI)(4-(2-Bromoethyl)phenyl)boronicacidSCHEMBL9145073DTXSID60631612FFNGHXMQOMKXOW-UHFFFAOYSA-N4-(2-Bromoethyl)phenyl boronic acidAKOS015893140BS-20882DB-366701CS-0175150H61779F211358
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