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

1,3,5-Trimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole structure

CAS No:
844891-04-9
Formula:
C12H21BN2O2
Chemical Name:
1,3,5-Trimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
Synonyms:
1H-Pyrazole,1,3,5-trimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-;1,3,5-Trimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;(1,3,5-Trimethyl-1H-pyrazol-4-yl)boronic acid pinacol ester;2-(1,3,5-Trimethylpyrazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;1,3,5-Trimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole;1,3,5-Trimethyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;1,3,5-Trimethyl-1H-pyrazole-4-boronic acid pinacol ester
Categories:
Organic Chemistry > Boron Compounds

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1,3,5-Trimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole Basic Attributes

Molecular Weight：

236.12

Exact Mass：

236.12

DSSTox ID：

DTXSID20383620

HScode：

2934999090

Characteristics

PSA：

36.28000

XLogP3：

1.33610

Density：

1.04±0.1 g/cm3

Melting Point：

98-100 °C

Boiling Point：

335.7±42.0 °C(Predicted)

Flash Point：

156.8ºC

Refractive Index：

1.503

PKA：

3.13±0.10

Safety Information

wgk germany：

hazard class code：

36/37/38-22

safety instructions：

26-36/37/39-36-22

Marks：

Xi,Xn

Precautionary statement(s)：

P261; P305 + P351 + P338

Hazard Statements：

H315; H319; H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:236.12
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:236.1696081
Monoisotopic Mass:236.1696081
Topological Polar Surface Area:36.3
Heavy Atom Count:17
Complexity:293
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1,3,5-TRIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE

CAS No.: 844891-04-9

Content: 99.00%

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1,3,5-TRIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE

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CAS No.: 844891-04-9

Content: 98%

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Guide of 1,3,5-Trimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

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