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1,3-diphenylpyrazole-4-carbaldehyde

1,3-diphenylpyrazole-4-carbaldehyde structure

CAS No:
21487-45-6
Formula:
C16H12N2O
Chemical Name:
1,3-diphenylpyrazole-4-carbaldehyde
Synonyms:
1,3-diphenyl-1H-pyrazol-4-carboxaldehyde; 1,3-Diphenyl-1H-pyrazole-4-carbaldehyde; 1,3-diphenyl-1H-pyrazole-4-carboxaldehyde; 1,3-diphenyl-1H-pyrazole-3-carbaldehyde; 1,3-Diphenyl-4-pyrazolecarboxaldehyde; 1,3-diphenyl-pyrazole-4-carboxaldehyde;Expand
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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1,3-diphenylpyrazole-4-carbaldehyde Basic Attributes

Molecular Weight：

248.27900

Exact Mass：

248.094963011 g/mol

DSSTox ID：

DTXSID60339388

HScode：

2933199090

Characteristics

PSA：

34.89000

XLogP3：

3.35180

Density：

1.14g/cm3

Melting Point：

142-146ºC

Boiling Point：

442.2ºC at 760mmHg

Flash Point：

221.2ºC

Refractive Index：

1.621

Water Solubility：

<0.3 [ug/mL]

Vapor Pressure：

5.13E-08mmHg at 25°C

Safety Information

hazard class code：

R36/37/38; R41; R37/38

safety instructions：

S26; S36/37/39; S39

Marks：

Precautionary statement(s)：

P261; P280; P305 + P351 + P338

Hazard Statements：

H315; H318; H335

GHS Classification：

|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:248.28
XLogP3:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:248.094963011
Monoisotopic Mass:248.094963011
Topological Polar Surface Area:34.9
Heavy Atom Count:19
Complexity:295
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-diphenylpyrazole-4-carbaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties
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