1-(4-ETHOXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE
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1-(4-ETHOXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE
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CAS No:
15182-68-0
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Formula:
C9H10N4OS
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Chemical Name:
1-(4-ETHOXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE
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Synonyms:
1-(4-ethoxyphenyl)-1,2-dihydro-5H-Tetrazole-5-thione;1-(4-ETHOXYPHENYL)-1H-TETRAZOLE-5-THIOL;1-(4-ETHOXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE;AKOS BBS-00000556;4-(5-MERCAPTOTETRAZOLO)PHENETOLE;4-ETHOXY PMT;4-(5-mercaptotetrazole)Phenetole;1-(4-Ethoxyphenyl)-5-mercapto-1H-tetrazole
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CAS No:
1-(4-ETHOXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE Basic Attributes
222.27
222.05800
DTXSID70357417
2933990090
Characteristics
81.3
1.34970
1.39±0.1 g/cm3(Predicted)
160 °C
320.1±44.0 °C(Predicted)
147.4ºC
1.683
0.000325mmHg at 25°C
Safety Information
III
4.1
1325
2
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed . R34:Causes burns. R40:Limited evidence of a carcinogenic effect. R43:May cause sensitization by skin contact. R36/37:Irritating to eyes and respiratory system . R12:Extremely Flammable.
S36/37-S33-S16-S26
LP8925000
T,Xn,F+,F
P210, P240, P241, P280, P37, P378
H228
|Warning|H228 (100%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P280, and P370+P378|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:222.27
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:222.05753213
Monoisotopic Mass:222.05753213
Topological Polar Surface Area:81.3
Heavy Atom Count:15
Complexity:263
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
1-(4-ETHOXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE
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