2-(3-hydrazinyl-5-nitrophenoxy)ethanol

C8H11N3O4 — CID 80912775

IUPAC2-(3-hydrazinyl-5-nitrophenoxy)ethanol
SMILESNNc1cc(OCCO)cc([N+](=O)[O-])c1
InChIInChI=1S/C8H11N3O4/c9-10-6-3-7(11(13)14)5-8(4-6)15-2-1-12/h3-5,10,12H,1-2,9H2
InChIKeyPVURPOGBKVSYDF-UHFFFAOYSA-N
MW213.19 g/mol
LogP0.25
Rot. Bonds5

About 2-(3-hydrazinyl-5-nitrophenoxy)ethanol

2-(3-hydrazinyl-5-nitrophenoxy)ethanol (PubChem CID 80912775) has the molecular formula C8H11N3O4 and a molecular weight of 213.19 g/mol. Its IUPAC name is 2-(3-hydrazinyl-5-nitrophenoxy)ethanol.

Molecular Properties

Compound Name2-(3-hydrazinyl-5-nitrophenoxy)ethanol
PubChem CID80912775
Molecular FormulaC8H11N3O4
Molecular Weight213.19 g/mol
Exact Mass213.07
IUPAC Name2-(3-hydrazinyl-5-nitrophenoxy)ethanol
SMILESNNc1cc(OCCO)cc([N+](=O)[O-])c1
InChIInChI=1S/C8H11N3O4/c9-10-6-3-7(11(13)14)5-8(4-6)15-2-1-12/h3-5,10,12H,1-2,9H2
InChIKeyPVURPOGBKVSYDF-UHFFFAOYSA-N
XLogP0.25
TPSA110.65 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.19
LogP ≤ 50.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3-nitro-5-pent-4-enoxyphenyl)hydrazine
CID 80922666
2-[3-nitro-5-(propylamino)phenoxy]ethanol
CID 80860789
N-[2-(3-hydrazinyl-5-nitrophenoxy)ethyl]-N-propan-2-ylpropan-2-amine
CID 115506037
[3-[(E)-but-2-enoxy]-5-nitrophenyl]hydrazine
CID 80930909
(3-nitro-5-phenylmethoxyphenyl)hydrazine
CID 80910196
[4-(3-hydrazinyl-5-nitrophenoxy)phenyl]methanol
CID 80920971
2-(3-hydrazinyl-5-nitrophenyl)sulfanylethanol
CID 80921240
[3-nitro-5-(3-nitrophenoxy)phenyl]hydrazine
CID 80912353
3-(3-hydrazinyl-5-nitroanilino)propan-1-ol
CID 80944084
[3-[(6-methylcyclohex-3-en-1-yl)methoxy]-5-nitrophenyl]hydrazine
CID 80914835
4-(3-nitro-5-propoxyanilino)pentan-1-ol
CID 80724212
N-(3-ethoxy-5-nitrophenyl)hydroxylamine
CID 130500571

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydrazinyl-5-nitrophenoxy)ethanol?
The IUPAC name of 2-(3-hydrazinyl-5-nitrophenoxy)ethanol (CID 80912775) is 2-(3-hydrazinyl-5-nitrophenoxy)ethanol.
What is the SMILES notation for 2-(3-hydrazinyl-5-nitrophenoxy)ethanol?
The canonical SMILES for 2-(3-hydrazinyl-5-nitrophenoxy)ethanol is NNc1cc(OCCO)cc([N+](=O)[O-])c1.
What is the InChIKey of 2-(3-hydrazinyl-5-nitrophenoxy)ethanol?
The InChIKey is PVURPOGBKVSYDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O4/c9-10-6-3-7(11(13)14)5-8(4-6)15-2-1-12/h3-5,10,12H,1-2,9H2.
What are the key properties of 2-(3-hydrazinyl-5-nitrophenoxy)ethanol?
2-(3-hydrazinyl-5-nitrophenoxy)ethanol has a molecular weight of 213.19 g/mol, XLogP of 0.25, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydrazinyl-5-nitrophenoxy)ethanol is sourced from PubChem (CID 80912775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).