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Ethyl 5-methyl-1-phenyl-1H-pyrazole-4-carboxylate

Ethyl 5-methyl-1-phenyl-1H-pyrazole-4-carboxylate structure

CAS No:
89193-16-8
Formula:
C13H14N2O2
Chemical Name:
Ethyl 5-methyl-1-phenyl-1H-pyrazole-4-carboxylate
Synonyms:
1H-Pyrazole-4-carboxylic acid,5-methyl-1-phenyl-,ethyl ester;Pyrazole-4-carboxylic acid,5-methyl-1-phenyl-,ethyl ester;Ethyl 5-methyl-1-phenyl-1H-pyrazole-4-carboxylate;NSC 85879;Ethyl 5-methyl-1-phenylpyrazole-4-carboxylate;5-Methyl-1-phenyl-1H-pyrazole-4-carboxylic acid ethyl ester;5-Methyl-1-phenylpyrazole-4-carboxylic acid ethyl ester

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Ethyl 5-methyl-1-phenyl-1H-pyrazole-4-carboxylate Basic Attributes

Molecular Weight：

230.26

Exact Mass：

230.26

EC Number：

289-479-7

NSC Number：

85879

DSSTox ID：

DTXSID70237568

HScode：

2933199090

Characteristics

PSA：

44.12000

XLogP3：

2.35740

Density：

1.13

Melting Point：

55-56 °C

Boiling Point：

338.1ºC

Flash Point：

158.3ºC

Refractive Index：

1.568

Storage Conditions：

-20ºC Freezer

Safety Information

Hazard category：

IRRITANT

hazard class code：

36/37/38

safety instructions：

26-36/37/39-24/25

GHS Classification：

|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:230.26
XLogP3:2.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:230.105527694
Monoisotopic Mass:230.105527694
Topological Polar Surface Area:44.1
Heavy Atom Count:17
Complexity:264
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl 5-methyl-1-phenyl-1H-pyrazole-4-carboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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