2-aminoacetic acid

• ChemBase ID: 134760
• Molecular Formular: C2H5NO2
• Molecular Mass: 76.0600089
• Monoisotopic Mass: 76.0290633
• SMILES: C(C(=O)O)[15NH2]
• Canonical SMILES: [15NH2]CC(=O)O
• InChI: InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i3+1
• InChIKey: DHMQDGOQFOQNFH-LBPDFUHNSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-aminoacetic acid
• IUPAC Traditional name: glycine
• Synonyms: Glycine-15N; Glycine-15N,d5; 甘氨酸-15N; 甘氨酸-15N,d5

Database IDs

• CAS Number: 7299-33-4
• MDL Number: MFCD08702806; MFCD00064426
• Beilstein Number: 1853034
• PubChem SID: 24873329; 24858032; 162229036
• PubChem CID: 134627

CALCULATED PROPERTIES

• Acid pKa: 2.307457
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -3.4094565
• LogD (pH = 7.4): -3.4150424
• Log P: -3.4094596
• Molar Refractivity: 16.0034 cm^3
• Polarizability: 6.549665 Å^3
• Polar Surface Area: 63.32 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 240 °C (dec.)(lit.)
• Mass Shift: M+1; M+6

Safety Information

• German water hazard class: 1; 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Grade: purum
• Isotopic Purity: 98 atom % 15N; 98 atom % D
• Suitability: S & P tested
• Mol. Weight: mol wt 76.04 by atom % calculation; mol wt 80.97 by atom % calculation
• Linear Formula: D215NCD2CO2D; H215NCH2CO2H

DETAILS

Sigma Aldrich - 660736

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Sigma Aldrich - 592617

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Sigma Aldrich - 299294

Packaging
1 g in glass bottle
250 mg in glass bottle
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.