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CAS No.: | 51537-21-4 |
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Name: | H-SER(TBU)-OTBU HCL |
Molecular Structure: | |
Formula: | C11H24ClNO3 |
Molecular Weight: | 253.769 |
Synonyms: | Alanine,3-tert-butoxy-, tert-butyl ester, hydrochloride (6CI,7CI);L-Serine,O-(1,1-dimethylethyl)-, 1,1-dimethylethyl ester, hydrochloride (9CI);(S)-2-Amino-3-tert-butoxypropionic acid tert-butyl ester hydrochloride;NSC164061;O-tert-Butyl-L-serine tert-butyl ester hydrochloride; |
Density: | 0.969g/cm3 |
Melting Point: | 170-177℃ |
Boiling Point: | 318.4 °C at 760 mmHg |
Flash Point: | 146.4 °C |
PSA: | 61.55000 |
LogP: | 2.97280 |
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The L-Serine,O-(1,1-dimethylethyl)-, 1,1-dimethylethyl ester, hydrochloride (1:1), with the CAS registry number 51537-21-4, has the systematic name of tert-butyl O-tert-butyl-L-serinate hydrochloride. It belongs to the following product categories: Amino Acids; Amino hydrochloride; Amino Acid Derivatives; Peptide Synthesis; Serine. And the molecular formula of the chemical is C11H24ClNO3. What's more, it should be stored at 0-5°C.
The characteristics of L-Serine,O-(1,1-dimethylethyl)-, 1,1-dimethylethyl ester, hydrochloride (1:1) are as followings: (1)ACD/LogP: 2.30; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 7; (6)Polar Surface Area: 38.77 Å2; (7)Flash Point: 146.4 °C; (8)Enthalpy of Vaporization: 57.1 kJ/mol; (9)Boiling Point: 318.4 °C at 760 mmHg; (10)Vapour Pressure: 0.000265 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cl.O=C(OC(C)(C)C)[C@@H](N)COC(C)(C)C
(2)InChI: InChI=1/C11H23NO3.ClH/c1-10(2,3)14-7-8(12)9(13)15-11(4,5)6;/h8H,7,12H2,1-6H3;1H/t8-;/m0./s1
(3)InChIKey: RDWZQVGVBTYCBD-QRPNPIFTBV