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CAS No.: | 161879-12-5 |
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Name: | H-PHG-OTBU HCL |
Molecular Structure: | |
Formula: | C12H18ClNO2 |
Molecular Weight: | 243.73 |
Synonyms: | Benzeneaceticacid, a-amino-, 1,1-dimethylethyl ester,hydrochloride, (S)-;Benzeneacetic acid, a-amino-, 1,1-dimethylethyl ester, hydrochloride, (aS)- (9CI);(S)-Phenylglycinetert-butyl ester hydrochloride;L-Phenylglycine tert-butyl ester hydrochloride; |
PSA: | 52.32000 |
LogP: | 3.53040 |
The Benzeneacetic acid, a-amino-, 1,1-dimethylethyl ester,hydrochloride (1:1), (aS)-, with CAS registry number 161879-12-5, belongs to the following product categories: (1)Amino Acid Derivatives; (2)Amino Acids. It has the systematic name of tert-butyl (2S)-2-amino-2-phenyl-acetate hydrochloride. This chemical should be stored at the temperature of -15°C. And the chemical formula of this chemical is C12H18ClNO2.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)[C@H](c1ccccc1)N.Cl
(2)InChI: InChI=1/C12H17NO2.ClH/c1-12(2,3)15-11(14)10(13)9-7-5-4-6-8-9;/h4-8,10H,13H2,1-3H3;1H/t10-;/m0./s1
(3)InChIKey: CBYKTKOQAVJTOU-PPHPATTJBO
(4)Std. InChI: InChI=1S/C12H17NO2.ClH/c1-12(2,3)15-11(14)10(13)9-7-5-4-6-8-9;/h4-8,10H,13H2,1-3H3;1H/t10-;/m0./s1
(5)Std. InChIKey: CBYKTKOQAVJTOU-PPHPATTJSA-N