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3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-, hydrochloride (1:?)

3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-, hydrochloride (1:?) structure

CAS No:
13576-96-0
Formula:
C14H19N3O.xClH
Chemical Name:
3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-, hydrochloride (1:?)
Synonyms:
3H-Pyrazol-3-one,1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-,hydrochloride (1:?);Antipyrine,4-(isopropylamino)-,hydrochloride;3H-Pyrazol-3-one,1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-,hydrochloride;Isopyrin hydrochloride

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3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-, hydrochloride (1:?) Basic Attributes

Molecular Weight：

281.78100

Exact Mass：

281.1294900 g/mol

EC Number：

237-010-1|242-222-2

UNII：

182MZB7ZV8

NSC Number：

758621

Characteristics

PSA：

38.96000

XLogP3：

3.17970

Boiling Point：

348.5ºC

Flash Point：

164.6ºC

Vapor Pressure：

5E-05mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

4-isopropylamino-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one

Computed Properties

Molecular Weight:281.78
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:281.1294900
Monoisotopic Mass:281.1294900
Topological Polar Surface Area:35.6
Heavy Atom Count:19
Complexity:356
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-, hydrochloride (1:?)

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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