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4-Phenyl-1H-pyrazol-3-amine

4-Phenyl-1H-pyrazol-3-amine structure

CAS No:
5591-70-8
Formula:
C9H9N3
Chemical Name:
4-Phenyl-1H-pyrazol-3-amine
Synonyms:
1H-Pyrazol-3-amine,4-phenyl-;Pyrazole,3(or 5)-amino-4-phenyl-;4-Phenyl-1H-pyrazol-3-amine;SKF 1572;3-Amino-4-phenylpyrazole;4-Phenylpyrazol-3-amine;4-Phenyl-5-pyrazolamine;(4-Phenyl-1H-pyrazol-3-yl)amine;(4-Phenylpyrazol-3-yl)amine;27374-44-3
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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4-Phenyl-1H-pyrazol-3-amine Basic Attributes

Molecular Weight：

159.18800

Exact Mass：

159.19

DSSTox ID：

DTXSID10204512

Characteristics

PSA：

54.70000

XLogP3：

2.24010

Density：

1.238g/cm3

Melting Point：

178-179 °C @ Solvent: Water, Ethanol

Boiling Point：

394.4ºC at 760mmHg

Flash Point：

220.9ºC

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H302-H315-H319-H335

GHS Classification：

|Warning|H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:159.19
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:159.079647300
Monoisotopic Mass:159.079647300
Topological Polar Surface Area:54.7
Heavy Atom Count:12
Complexity:143
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Phenyl-1H-pyrazol-3-amine

Basic Attributes
Characteristics
Safety Information
Computed Properties
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4-Phenyl-1H-pyrazol-3-amine

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