B(C1=C(N=CC=C1)Cl)(O)O
CAS: 381248-04-0
Nombre: (2-chloro-3-pyridinyl)boronic acid
SMILES: B(C1=C(N=CC=C1)Cl)(O)O

Molecular Processing

Molecular formula
C5H5BClNO2
Molecular weight
157.37
Exact mass
157.0102
XLogP
-0.59
TPSA
53.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.07

Supplementary Information

InChIKey: VRDAOVQZVXYRNH-UHFFFAOYSA-N
Sinónimos
(2-chloropyridin-3-yl)boronic AcidDTXSID00376378RefChem:1049676DTXCID00327406381248-04-02-Chloropyridine-3-boronic acid2-Chloro-3-pyridylboronic acid2-chloropyridin-3-ylboronic acid2-chloro-3-pyridineboronic acidMFCD03094997(2-chloro-3-pyridyl)boronic acid2-Chloro-3-pyridyl boronic acidBORONIC ACID, B-(2-CHLORO-3-PYRIDINYL)-2-chloropyridin-3-yl-3-boronic acid2-chloro-3-pyridinylboronic acidBORONIC ACID, (2-CHLORO-3-PYRIDINYL)-SCHEMBL3157542-chlorpyridine-3-boronic acid2-choropyridine-3-boronic acidorb2940115CHEMBL3236607SCHEMBL29587911VRDAOVQZVXYRNH-UHFFFAOYSA-N(2-chloropyridin-3-yl)boronicAcidCS-D1047SBB052572TYD-00464AKOS000285082AS-3108PB10233
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