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CAS No.: | 15028-39-4 | ||||||||
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Name: | H-PHG-OME HCL | ||||||||
Article Data: | 46 | ||||||||
Molecular Structure: | |||||||||
Formula: | C9H11 N O2 . Cl H | ||||||||
Molecular Weight: | 201.653 | ||||||||
Synonyms: | Benzeneaceticacid, a-amino-, methyl ester,hydrochloride, (S)-; Benzeneacetic acid, a-amino-, methyl ester, hydrochloride, (aS)- (9CI); Glycine, 2-phenyl-,methyl ester, hydrochloride, L- (8CI);((S)-2-Methoxy-2-oxo-1-phenylethyl)ammonium chloride; (L)-Methylphenylglycinate hydrochloride; (S)-(+)-2-Phenylglycine methyl ester hydrochloride;(S)-2-Phenylglycine methyl ester hydrochloride; (S)-Methyl2-amino-2-phenylacetate hydrochloride; (S)-Phenylglycine methyl esterhydrochloride; L-Phenylglycine methyl ester hydrochloride; Methyl(2S)-2-amino-2-phenylacetate hydrochloride; Methyl (S)-amino(phenyl)acetatehydrochloride; Methyl (S)-phenylglycinate hydrochloride; MethylL-(+)-phenylglycinate hydrochloride; Methyl L-phenylglycinate hydrochloride;Phenylglycine methyl ester hydrochloride | ||||||||
Density: | g/cm3 | ||||||||
Melting Point: |
200 °C (dec.)(lit.) |
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Boiling Point: | 238.9°Cat760mmHg | ||||||||
Flash Point: | 104.7°C | ||||||||
Hazard Symbols: | |||||||||
Risk Codes: | R36 | ||||||||
Safety: |
|
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PSA: | 52.32000 | ||||||||
LogP: | 2.36170 |
(S)-methyl 2-((S)-1-phenylethylamino)-2-phenylacetate
L-2-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
With hydrogenchloride; hydrogen; palladium dihydroxide In methanol under 760.051 Torr; for 15h; | 100% |
With hydrogenchloride; palladium hydroxide on carbon; hydrogen In methanol; water under 760.051 Torr; for 15h; optical yield given as %ee; | 100% |
Conditions | Yield |
---|---|
With thionyl chloride for 10h; Ambient temperature; | 99% |
With thionyl chloride for 8h; Heating; | 97% |
With thionyl chloride In methanol at 20℃; Cooling with ice; | 97% |
(S)-2-phenylglycine
2,2-dimethoxy-propane
L-2-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
With hydrogenchloride In water at 20℃; | 99% |
With hydrogenchloride at 20℃; for 18h; | 94% |
N-tert-butoxycarbonyl-L-phenylglycine methyl ester
L-2-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
With hydrogenchloride In dichloromethane; ethyl acetate at 20℃; for 0.833333h; Inert atmosphere; | 97% |
methanol
(S)-α-phenylglycinenitrile
L-2-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
With hydrogenchloride | 88% |
With hydrogenchloride; water | 88% |
methanol
(R)-phenylglycine
A
L-2-phenylglycine methyl ester hydrochloride
B
D-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
With thionyl chloride for 20h; Ambient temperature; | A n/a B 76% |
N-phthaloylglycine chloride
N-benzyliden-α-phenyl-glycine methyl ester
C
L-2-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
With 2,6-dimethylpyridine In toluene at 20℃; Staudinger Ketene Cycloaddition; Reflux; Inert atmosphere; | A 11% B 4% C 29% |
(R)-methyl mandelate
A
L-2-phenylglycine methyl ester hydrochloride
B
D-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
e.e. = 76percent; Multistep reaction. Title compound not separated from byproducts; |
N-benzyliden-α-phenyl-glycine methyl ester
A
L-2-phenylglycine methyl ester hydrochloride
B
D-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
Product distribution; multistep reaction; deracemisation was investigated by means of dipivaloyltartaric acids of different chirality in the presence of chiral amines of structure Ph-CHCH3-NHR; other temperature, acid, base; | |
Yield given. Multistep reaction. Yields of byproduct given. Title compound not separated from byproducts; |
N-benzylidenephenylglycine methyl ester
A
L-2-phenylglycine methyl ester hydrochloride
B
D-phenylglycine methyl ester hydrochloride
Conditions | Yield |
---|---|
With (-)-O,O′-di-pivaloyl-L-tartaric acid; lithium (R)-N-methyl-N-α-methylbenzyl amide Product distribution; other lithium amides and diacyltartaric acides; | |
With (R)-PhCH(CH3)NLiCH2CH3; (3R) HOOCCH(OCOtC4H9)CH(OCOtC4H9)COOH 1.) THF, - 50 deg C; 2.) THF, -70 deg C; Yield given. Multistep reaction. Yields of byproduct given; |
Molecular Structure of L-Phenylglycine methyl ester hydrochloride (15028-39-4):
Systematic Name: Methyl (2S)-2-amino-2-phenyl-acetate hydrochloride
Molecular Formula: C9H12ClNO2
Molecular Weight: 201.6501
SMILES: Cl.O=C(OC)[C@@H](N)c1ccccc1
InChI: InChI=1/C9H11NO2.ClH/c1-12-9(11)8(10)7-5-3-2-4-6-7;/h2-6,8H,10H2,1H3;1H/t8-;/m0./s1
InChIKey: DTHMTBUWTGVEFG-QRPNPIFTBM
Flash Point: 104.7 °C
Melting Point: 200 °C (dec.)(lit.)
Boiling Point: 238.9 °C at 760 mmHg
Enthalpy of Vaporization: 47.58 kJ/mol
Vapour Pressure: 0.0412 mmHg at 25 °C
Storage Temp.: 2-8 °C
Safety Information of L-Phenylglycine methyl ester hydrochloride (15028-39-4):
Hazard Codes: Xi
Risk Statements: 36
36: Irritating to the eyes
Safety Statements: 26-36/37
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36/37: Wear suitable protective clothing and gloves
WGK Germany: 3
L-Phenylglycine methyl ester hydrochloride (15028-39-4) is also known as H-PHG-OME HCL ; L-Phenyl glycine methyl ester HCL ; L-Phenylglycine methyl ester hydrochloride salt ; H-(PH)GLY-OME HCL; (S)-(+)-2-Phenylglycine methyl ester hydrochlorid ; Phenylglycine-OME HCL .