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N-(2,6-Dimethylphenyl)alanine methyl ester

N-(2,6-Dimethylphenyl)alanine methyl ester structure

CAS No:
52888-49-0
Formula:
C12H17NO2
Chemical Name:
N-(2,6-Dimethylphenyl)alanine methyl ester
Synonyms:
Alanine,N-(2,6-dimethylphenyl)-,methyl ester;DL-Alanine,N-(2,6-dimethylphenyl)-,methyl ester;(±)-α-(2,6-Dimethylanilino)propionic acid methyl ester;Methyl (±)-α-(2,6-dimethylanilino)propionate;CGA 67891;Methyl (±)-2-(2,6-dimethylphenylamino)propionate;N-(2,6-Dimethylphenyl)alanine methyl ester;57646-31-8

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N-(2,6-Dimethylphenyl)alanine methyl ester Basic Attributes

Molecular Weight：

207.27

Exact Mass：

207.27

EC Number：

258-237-2

Characteristics

PSA：

38.3 Å²

Density：

1.063±0.06 g/cm3

Boiling Point：

98-100 °C @ Press: 4 Torr

PKA：

2.95±0.50

Safety Information

GHS Classification：

|H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|P273, P391, and P501|Aggregated GHS information provided by 192 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:207.27
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:207.125928785
Monoisotopic Mass:207.125928785
Topological Polar Surface Area:38.3
Heavy Atom Count:15
Complexity:208
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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methyl N-(2,6-dimethylphenyl)-DL-alaninate

CAS No.: 52888-49-0

Content: 99.00%

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Guide of N-(2,6-Dimethylphenyl)alanine methyl ester

Basic Attributes
Characteristics
Safety Information
Computed Properties
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