D-Glutamicacid, 5-methyl ester supplier

Name
H-D-GLU(OME)-OH
EINECS 229-276-2
CAS No. 6461-04-7
Article Data17
CAS DataBase
Density 1.242 g/cm³
Solubility
Melting Point 175-176℃
Formula C₆H₁₁NO₄
Boiling Point 316.1 °C at 760 mmHg
Molecular Weight 161.158
Flash Point 145 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Glutamicacid, 5-methyl ester, D- (8CI);4(R)-Carboxy-4-aminobutanoic acid methyl ester;5-Methyl D-glutamate;H-D-Glu(OMe)-OH;g-Methyl D-glutamate;(2R)-2-Amino-5-methoxy-5-oxopentanoic acid;
PSA 92.45000
LogP -1.28290

D-Glutamicacid, 5-methyl ester Specification

The D-Glutamicacid, 5-methyl ester, with the CAS registry number 6461-04-7, is also known as 5-Methyl D-glutamate. Its EINECS number is 229-276-2. This chemical's molecular formula is C₆H₁₁NO₄ and molecular weight is 161.16. What's more, its systematic name is (2R)-2-amino-5-methoxy-5-oxopentanoic acid.

Physical properties of D-Glutamicacid, 5-methyl ester are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 5; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 6; (9)Polar Surface Area: 92.45 Å²; (10)Flash Point: 145 °C; (11)Enthalpy of Vaporization: 61.29 kJ/mol; (12)Boiling Point: 316.1 °C at 760 mmHg; (13)Vapour Pressure: 8.95E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC(=O)CCC(C(=O)O)N
(2)Isomeric SMILES: COC(=O)CC[C@H](C(=O)O)N
(3)InChI: InChI=1S/C6H11NO4/c1-11-5(8)3-2-4(7)6(9)10/h4H,2-3,7H2,1H3,(H,9,10)/t4-/m1/s1
(4)InChIKey: ZGEYCCHDTIDZAE-SCSAIBSYSA-N

Product Name

H-D-GLU(OME)-OH

D-Glutamicacid, 5-methyl ester Specification

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