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2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid structure
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2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid

TL;DR: 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid (CAS 124842-39-3) is a chemical compound with molecular formula C12H12N2O6 and molecular weight 280.06955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[3-(carboxymethylcarbamoyl)benzoyl]amino]acetic acid

Also Known As: N,N -Bis(carboxymethyl)isophthalamide, Glycine, N,N'-(1,3-phenylenedicarbonyl)bis-, J3.125.003J, 2-[[3-(carboxymethylcarbamoyl)benzoyl]amino]acetic acid, 2-({3-[(carboxymethyl)carbamoyl]phenyl}formamido)acetic acid

CAS Number
124842-39-3
Molecular Formula
C12H12N2O6
Molecular Weight
280.06955 g/mol
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Technical Specifications

Molecular FormulaC12H12N2O6
Molecular Weight280.06955 g/mol
XLogP-0.8
Topological Polar Surface Area (TPSA)133.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass280.06955 Da
Heavy Atoms20
Complexity373.0
SMILESC1=CC(=CC(=C1)C(=O)NCC(=O)O)C(=O)NCC(=O)O
InChIKeyJALGRXWGRUDMLW-UHFFFAOYSA-N

Chemical Property Profile of 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid

XLogP
-0.8
TPSA (Topological Polar Surface Area)
133.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
20
Complexity
373.0
Exact Mass
280.06955
Monoisotopic Mass
280.06955
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-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid

The XLogP value of -0.8 indicates that 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid. Following Lipinski's Rule of Five, 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid has 4 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-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid?

The CAS number of 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid is 124842-39-3.

What is the molecular formula of 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid?

The molecular formula of 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid is C12H12N2O6.

What is the molecular weight of 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid?

The molecular weight of 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid is 280.06955 g/mol.

Where can I buy 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid?

You can request a quote for 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid?

Yes, CoreyChem provides custom synthesis services for 2-({3-[N-(carboxymethyl)carbamoyl]phenyl}carbonylamino)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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