Valsartan n-Propyl
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Valsartan n-Propyl
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CAS No:
952652-79-8
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Formula:
C23H27N5O3
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Chemical Name:
Valsartan n-Propyl
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Synonyms:
Valsartan n-Propyl;Valsartan n-Propyl Impurity;L-Valine, N-(1-oxobutyl)-N-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4- yl]methyl]-;(S)-N-Butyryl-N-([2'-(1H-tetrazole-5-yl)biphen-4-yl]methyl)valine;Valsartan n-Propyl IMpurity:(S)-N-butyryl-N-{[2'-(1-H-tetrazole-5-yl)-biphenyl-4-yl]-Methyl}-valine;N-butyryl-N-{[2'-(1H-tetrazole-5-yl)-biphenyl-4-yl]Methyl}-L-valine;N-(1-Oxobutyl)-N-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]Methyl]-;(S)-2-(N-((2'-(1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)Methyl)butyraMido)-3-Methylbutanoic acid
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CAS No:
Characteristics
112
4.21
1.2±0.1 g/cm3
>149·C (dec.)
679.0±65.0 °C at 760 mmHg
364.5±34.3 °C
1.592
Refrigerator
Safety Information
22
24/25
Xn
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory.
Valsartan n-Propyl Use and Manufacturing
Valsartan n-Propyl is animpurity in the synthesis of Valsartan (V095750).
Computed Properties
Molecular Weight:421.5
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:421.21138974
Monoisotopic Mass:421.21138974
Topological Polar Surface Area:112
Heavy Atom Count:31
Complexity:594
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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