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1-[2-(2-aminoacetamido)acetyl]pyrrolidine-2-carboxylic acid

1-[2-(2-aminoacetamido)acetyl]pyrrolidine-2-carboxylic acid

CAS: 14379-76-1

Formula: C9H15N3O4

SMILES: NCC(=O)NCC(=O)N1CCCC1C(O)=O

IUPAC: 1-[2-(2-aminoacetamido)acetyl]pyrrolidine-2-carboxylic acid

InChI: InChI=1/C9H15N3O4/c10-4-7(13)11-5-8(14)12-3-1-2-6(12)9(15)16/h6H,1-5,10H2,(H,11,13)(H,15,16)

Composition: C (47.16%), H (6.60%), N (18.33%), O (27.92%)

Molar Mass: 229.236

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 229.106255975
Formal Charge 0
FSP3 0.67
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 3
InChIKey BUEFQXUHTUZXHR-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.79
Topological Polar Surface Area 112.73
Polarizability 21.2
Ring Count 1
Rotatable Bond Count 4

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98% <4 Days 14379-76-1 $34.40-$75.68$34.40$41.28$75.68
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