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2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester structure
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2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester

TL;DR: 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester (CAS 1310037-44-5) is a chemical compound with molecular formula C14H25NO6 and molecular weight 303.16818 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-[(2-methylpropan-2-yl)oxy]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid

Also Known As: Boc-Glu-OtBu, Boc-D-Glu-OtBu, 1-tert-Butyl Boc-DL-glutamate, Boc-L-Glutamic acid alpha-t-butyl ester, Boc-L-glutamic acid 1-tert-butyl ester

CAS Number
1310037-44-5
Molecular Formula
C14H25NO6
Molecular Weight
303.16818 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (12 patents) Peptides & Amino Acids (1 patents) Pharmaceutical Intermediates (14 patents)

Technical Specifications

Molecular FormulaC14H25NO6
Molecular Weight303.16818 g/mol
XLogP1.7
Topological Polar Surface Area (TPSA)102.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds9
Exact Mass303.16818 Da
Heavy Atoms21
Complexity391.0
SMILESCC(C)(C)OC(=O)C(CCC(=O)O)NC(=O)OC(C)(C)C
InChIKeyYMOYURYWGUWMFM-UHFFFAOYSA-N

Chemical Property Profile of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester

XLogP
1.7
TPSA (Topological Polar Surface Area)
102.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
9
Heavy Atoms
21
Complexity
391.0
Exact Mass
303.16818
Monoisotopic Mass
303.16818
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester

The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester. Following Lipinski's Rule of Five, 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester?

The CAS number of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester is 1310037-44-5.

What is the molecular formula of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester?

The molecular formula of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester is C14H25NO6.

What is the molecular weight of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester?

The molecular weight of 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester is 303.16818 g/mol.

Where can I buy 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester?

You can request a quote for 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester?

Yes, CoreyChem provides custom synthesis services for 2-Tert-butoxycarbonylamino-pentanedioic acid 1-tert-butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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