azido 2-azido-2-(2-hydroxyethoxy)acetate

C4H6N6O4 — CID 175327639

IUPACazido 2-azido-2-(2-hydroxyethoxy)acetate
SMILES[N-]=[N+]=NOC(=O)C(N=[N+]=[N-])OCCO
InChIInChI=1S/C4H6N6O4/c5-8-7-3(13-2-1-11)4(12)14-10-9-6/h3,11H,1-2H2
InChIKeyMUCVXAGORTWMPA-UHFFFAOYSA-N
MW202.13 g/mol
LogP0.40
Rot. Bonds6

About azido 2-azido-2-(2-hydroxyethoxy)acetate

azido 2-azido-2-(2-hydroxyethoxy)acetate (PubChem CID 175327639) has the molecular formula C4H6N6O4 and a molecular weight of 202.13 g/mol. Its IUPAC name is azido 2-azido-2-(2-hydroxyethoxy)acetate.

Molecular Properties

Compound Nameazido 2-azido-2-(2-hydroxyethoxy)acetate
PubChem CID175327639
Molecular FormulaC4H6N6O4
Molecular Weight202.13 g/mol
Exact Mass202.05
IUPAC Nameazido 2-azido-2-(2-hydroxyethoxy)acetate
SMILES[N-]=[N+]=NOC(=O)C(N=[N+]=[N-])OCCO
InChIInChI=1S/C4H6N6O4/c5-8-7-3(13-2-1-11)4(12)14-10-9-6/h3,11H,1-2H2
InChIKeyMUCVXAGORTWMPA-UHFFFAOYSA-N
XLogP0.40
TPSA153.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.13
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

2-bromo-2-(2-hydroxyethoxy)acetamide
CID 175386599
azido 2-amino-3-phenylpropanoate
CID 77211424
acetic acid;1-azido-2-(2-hydroxyethoxy)ethanol
CID 175140766
3-azido-2-ethylpentanamide
CID 152730747
azido (2S)-2-(2-diazohydrazinyl)-3-phenylpropanoate
CID 174520180
1-azido-2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 90413267
dimethyl 2-azido-5-bromohexanedioate
CID 11426390
ethyl (2S)-2-azidopropanoate
CID 15266179
2-[carboxy(2-hydroxyethoxy)methoxy]-2-(2-hydroxyethoxy)acetic acid
CID 118435325
1-[3-[2-azido-2-(2-hydroxyethoxy)ethoxy]phenyl]ethanone
CID 137418489
2-azido-3-hydroxypropanoic acid
CID 54415353
methyl 2-azidohexanoate
CID 22742063

Frequently Asked Questions

What is the IUPAC name of azido 2-azido-2-(2-hydroxyethoxy)acetate?
The IUPAC name of azido 2-azido-2-(2-hydroxyethoxy)acetate (CID 175327639) is azido 2-azido-2-(2-hydroxyethoxy)acetate.
What is the SMILES notation for azido 2-azido-2-(2-hydroxyethoxy)acetate?
The canonical SMILES for azido 2-azido-2-(2-hydroxyethoxy)acetate is [N-]=[N+]=NOC(=O)C(N=[N+]=[N-])OCCO.
What is the InChIKey of azido 2-azido-2-(2-hydroxyethoxy)acetate?
The InChIKey is MUCVXAGORTWMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N6O4/c5-8-7-3(13-2-1-11)4(12)14-10-9-6/h3,11H,1-2H2.
What are the key properties of azido 2-azido-2-(2-hydroxyethoxy)acetate?
azido 2-azido-2-(2-hydroxyethoxy)acetate has a molecular weight of 202.13 g/mol, XLogP of 0.40, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azido 2-azido-2-(2-hydroxyethoxy)acetate is sourced from PubChem (CID 175327639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).