Fmoc-L-glutamic acid 5-tert-butyl ester

• CAS: 71989-18-9
• Catalog Number: ACM71989189
• Category: Other Products
• Molecular Weight: 425.47
• Molecular Formula: C24H27NO6
• Synonyms: N-(9H-Fluorene-9-ylmethoxycarbonyl)-L-glutamic acid 5-tert-butyl ester
• IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid
• Canonical SMILES: CC(C)(C)OC(=O)CC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
• InChI: InChI=1S/C24H27NO6/c1-24(2,3)31-21(26)13-12-20(22(27)28)25-23(29)30-14-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,19-20H,12-14H2,1-3H3,(H,25,29)(H,27,28)/t20-/m0/s1
• InChI Key: OTKXCALUHMPIGM-FQEVSTJZSA-N
• Boiling Point: 633.5±55.0 °C
• Melting Point: 83-90 °C
• Density: 1.232±0.06 g/ml
• Appearance: White powder
• Hazard Statements: Xi
• pKa: 3.70±0.10
• Refractive Index: -4 ° (C=1, 80% AcOH)
• Safety Description: 26-27-36/37/39

Custom Q&A

What is the molecular formula of Fmoc-L-glutamic acid 5-tert-butyl ester?

The molecular formula of Fmoc-L-glutamic acid 5-tert-butyl ester is C24H27NO6.

What is the molecular weight of Fmoc-L-glutamic acid 5-tert-butyl ester?

The molecular weight of Fmoc-L-glutamic acid 5-tert-butyl ester is 425.5 g/mol.

What are some synonyms for Fmoc-L-glutamic acid 5-tert-butyl ester?

Some synonyms for Fmoc-L-glutamic acid 5-tert-butyl ester are Fmoc-Glu(OtBu)-OH and 71989-18-9.

When was Fmoc-L-glutamic acid 5-tert-butyl ester created and last modified?

Fmoc-L-glutamic acid 5-tert-butyl ester was created on 2005-07-19 and last modified on 2023-12-30.

What is the IUPAC name of Fmoc-L-glutamic acid 5-tert-butyl ester?

The IUPAC name of Fmoc-L-glutamic acid 5-tert-butyl ester is (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid.

What is the InChI of Fmoc-L-glutamic acid 5-tert-butyl ester?

The InChI of Fmoc-L-glutamic acid 5-tert-butyl ester is InChI=1S/C24H27NO6/c1-24(2,3)31-21(26)13-12-20(22(27)28)25-23(29)30-14-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,19-20H,12-14H2,1-3H3,(H,25,29)(H,27,28)/t20-/m0/s1.

What is the InChIKey of Fmoc-L-glutamic acid 5-tert-butyl ester?

The InChIKey of Fmoc-L-glutamic acid 5-tert-butyl ester is OTKXCALUHMPIGM-FQEVSTJZSA-N.

How many hydrogen bond donor counts does Fmoc-L-glutamic acid 5-tert-butyl ester have?

Fmoc-L-glutamic acid 5-tert-butyl ester has 2 hydrogen bond donor counts.

How many rotatable bond counts does Fmoc-L-glutamic acid 5-tert-butyl ester have?

Fmoc-L-glutamic acid 5-tert-butyl ester has 10 rotatable bond counts.

What is the topological polar surface area of Fmoc-L-glutamic acid 5-tert-butyl ester?

The topological polar surface area of Fmoc-L-glutamic acid 5-tert-butyl ester is 102 Å2.

Synthetic Use

Upstream Synthesis Route 1

• 56-86-0
• 102774-86-7
• 115-11-7

• 84793-07-7
• 71989-18-9
• 129460-14-6

Reference: [1] Synthesis, 1990, # 7, p. 571 - 572

Downstream Synthesis Route 1

• 71989-18-9

• 2419-56-9

Reference: [1] Patent: WO2011/19942, 2011, A2, . Location in patent: Page/Page column 31-32

Downstream Synthesis Route 2

• 71989-18-9

• 56-86-0
• 2419-56-9

Reference: [1] Amino Acids, 2014, vol. 46, # 2, p. 367 - 374

* For details of the synthesis route, please refer to the original source to ensure accuracy.