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3-amino-3-[(1-carboxyethyl)carbamoyl]propanoic acid

3-amino-3-[(1-carboxyethyl)carbamoyl]propanoic acid

Formula: C7H12N2O5

SMILES: CC(NC(=O)C(N)CC(O)=O)C(O)=O

IUPAC: 3-amino-3-[(1-carboxyethyl)carbamoyl]propanoic acid

InChI: InChI=1/C7H12N2O5/c1-3(7(13)14)9-6(12)4(8)2-5(10)11/h3-4H,2,8H2,1H3,(H,9,12)(H,10,11)(H,13,14)

Composition: C (41.18%), H (5.92%), N (13.72%), O (39.18%)

Molar Mass: 204.182

Atom Count: 26

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 204.074621494
Formal Charge 0
FSP3 0.57
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 4
InChIKey DVUFTQLHHHJEMK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.83
Topological Polar Surface Area 129.72
Polarizability 17.65
Ring Count 0
Rotatable Bond Count 5

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Purity LeadTime Formula UnitPrice
98% <10 Days C7H12N2O5 Quote Only