Benzenepropanenitrile, α-amino-3,4-dimethoxy-α-methyl-, hydrochloride (1:1), (αS)-
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Benzenepropanenitrile, α-amino-3,4-dimethoxy-α-methyl-, hydrochloride (1:1), (αS)-
structure -
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CAS No:
2544-13-0
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Formula:
C12H16N2O2.ClH
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Chemical Name:
Benzenepropanenitrile, α-amino-3,4-dimethoxy-α-methyl-, hydrochloride (1:1), (αS)-
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Synonyms:
Benzenepropanenitrile,α-amino-3,4-dimethoxy-α-methyl-,hydrochloride (1:1),(αS)-;Hydrocinnamonitrile,α-amino-3,4-dimethoxy-α-methyl-hydrochloride,L-(+)-;Benzenepropanenitrile,α-amino-3,4-dimethoxy-α-methyl-,monohydrochloride,(S)-
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CAS No:
Benzenepropanenitrile, α-amino-3,4-dimethoxy-α-methyl-, hydrochloride (1:1), (αS)- Basic Attributes
256.729
256.097870
219-823-3
DTXSID90388465
Characteristics
68.27000
2.84708
yellow or light-white crystalline powder
153-155 °C
361ºC at 760 mmHg
172.1ºC
2.13E-05mmHg at 25°C
Computed Properties
Molecular Weight:256.73
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:256.0978555
Monoisotopic Mass:256.0978555
Topological Polar Surface Area:68.3
Heavy Atom Count:17
Complexity:273
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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