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2-[Nitro(propyl)amino]acetic acid

HCID 178646830
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Basic information

CAS
79209-27-1
Standard SMILES
CCCN(CC(=O)O)[N+](=O)[O-]
InChIKey
YGSZKUFSWAADHE-UHFFFAOYSA-N
Molecular formula
C5H10N2O4
Average molar mass
162.14 g/mol
Monoisotopic mass
162.0640568

Names & identifiers

Preferred name
2-[Nitro(propyl)amino]acetic acid
IUPAC
2-[nitro(propyl)amino]acetic acid
English name
Glycine, N-nitro-N-propyl- (9CI)
Molecular formula
C5H10N2O4
Molecular weight
162.1439

Names & synonyms

glycine, n-nitro-n-propyl-79209-27-1Glycine, N-nitro-N-propyl- (9CI)

Database identifiers

CAS
79209-27-1
PubChem CID
12678521

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
86.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
11
Formal charge
0
Complexity
153

Chemistry & industry

Suppliers1 total

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Compound notes

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