1-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2(1H)-one
Properties
- Molecular formula
- C12H18BNO3
- Molar mass
- 235.09 g/mol
- Exact mass
- 235.1380 Da
- logP
- 0.68Crippen estimate
- Polar surface area
- 40.5 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1002309-52-5SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN(C(=O)C=C2)CInChIKey
IJUNZKOKAXJGRQ-UHFFFAOYSA-NInChI
InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-6-7-10(15)14(5)8-9/h6-8H,1-5H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 2(1H)-Pyridinone, 1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
Work with 1-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2(1H)-one
Similar compounds
2,2'-(1,4-Phenylene)bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane)99770-93-153 % similar
2,2'-((1,1'-Biphenyl)-4,4'-diyl)bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane)207611-87-849 % similar
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-ol1054483-78-146 % similar
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)toluene195062-57-846 % similar
4-Formylphenylboronic acid pinacol ester128376-64-745 % similar
2-(4-Fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane214360-58-445 % similar
4-(Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline214360-73-345 % similar
4-Hydroxyphenylboronic acid pinacol ester269409-70-345 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.