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1H-1,2,4-Triazole-1-ethanamine

1H-1,2,4-Triazole-1-ethanamine structure

CAS No:
51444-31-6
Formula:
C4H8N4
Chemical Name:
1H-1,2,4-Triazole-1-ethanamine
Synonyms:
1H-1,2,4-Triazole-1-ethanamine;1-(2-Aminoethyl)-1,2,4-triazole;2-(1,2,4-Triazolyl)ethylamine;2-(1,2,4-Triazol-1-yl)ethylamine;[2-(1H-1,2,4-Triazol-1-yl)ethyl]amine;2-(1H-1,2,4-Triazol-1-yl)ethanamine;2-(1,2,4-Triazol-1-yl)ethanamine;2-(1H-1,2,4-Triazol-1-yl)ethan-1-amine

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1H-1,2,4-Triazole-1-ethanamine Basic Attributes

Molecular Weight：

148.59400

Exact Mass：

112.13

DSSTox ID：

DTXSID00199423

HScode：

2933990090

Characteristics

PSA：

56.73000

XLogP3：

0.73910

Density：

1.318g/cm3

Boiling Point：

266.337ºC at 760 mmHg

Flash Point：

114.877ºC

Refractive Index：

1.634

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26; S36/37/39

GHS Classification：

|Warning|H302 (100%): 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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:112.13
XLogP3:-1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:112.074896272
Monoisotopic Mass:112.074896272
Topological Polar Surface Area:56.7
Heavy Atom Count:8
Complexity:65.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1H-1,2,4-Triazole-1-ethanamine

Basic Attributes
Characteristics
Safety Information
Computed Properties

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