4-methyl-1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

HCID 54772415
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Basic information

CAS
1492954-33-2
Standard SMILES
Cc1cnn(C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1
InChIKey
JUCGITVYAKQXHE-UHFFFAOYSA-N
Molecular formula
C15H25BN2O3
Average molar mass
292.18 g/mol

Names & identifiers

Preferred name
4-methyl-1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
IUPAC
4-methyl-1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
English name
4-methyl-1-(tetrahydro-2H-pyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-Pyrazole
Molecular formula
C15H25BN2O3
Molecular weight
292.18

Names & synonyms

1492954-33-2RefChem:5249174-methyl-1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole966-819-94-methyl-1-(oxan-2-yl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole4-methyl-1-(tetrahydro-2H-pyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole4-METHYL-1-(TETRAHYDRO-2H-PYRAN-2-YL)-1H-PYRAZOLE-5-BORONIC ACID PINACOL ESTERMFCD098376274-methyl-1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole4-Methyl-1-(tetrahydropyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleSCHEMBL15388527JUCGITVYAKQXHE-UHFFFAOYSA-N
Show more names
4-Methyl-1-(tetrahydro-2H-pyran-2-yl)pyrazole-5-boronic Acid Pinacol Ester4-methyl-1-(oxan-2-yl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole - [M20068]1H-Pyrazole, 4-methyl-1-(tetrahydro-2H-pyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
SJC95433ZB0764AKOS005259357SB11402AS-50646DA-39176SY259674CS-0050812

Database identifiers

CAS
1492954-33-2
PubChem CID
54772415
EC Number
966-819-9

Properties

Computed structural properties

Topological polar surface area
45.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
21

Physicochemical properties

Boiling point
428 · 428.0±45.0 °C(Predicted)
Density
1.14 · 1.14±0.1 g/cm3(Predicted)
storage temp.
2 · 2-8°C
form
solid
pka
2.58 · 2.58±0.19(Predicted)
Appearance
Colorless to off-white Solid-Liquid Mixture

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Suppliers37 total

上海康恩博医药科技有限公司17510465506 · [email protected]
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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