benzene;(2,4-dinitrophenyl)hydrazine

C12H12N4O4 — CID 159646359

IUPACbenzene;(2,4-dinitrophenyl)hydrazine
SMILESNNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].c1ccccc1
InChIInChI=1S/C6H6N4O4.C6H6/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14;1-2-4-6-5-3-1/h1-3,8H,7H2;1-6H
InChIKeyMQZWBBHMYKPTSC-UHFFFAOYSA-N
MW276.25 g/mol
LogP2.48
Rot. Bonds3

About benzene;(2,4-dinitrophenyl)hydrazine

benzene;(2,4-dinitrophenyl)hydrazine (PubChem CID 159646359) has the molecular formula C12H12N4O4 and a molecular weight of 276.25 g/mol. Its IUPAC name is benzene;(2,4-dinitrophenyl)hydrazine.

Molecular Properties

Compound Namebenzene;(2,4-dinitrophenyl)hydrazine
PubChem CID159646359
Molecular FormulaC12H12N4O4
Molecular Weight276.25 g/mol
Exact Mass276.09
IUPAC Namebenzene;(2,4-dinitrophenyl)hydrazine
SMILESNNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].c1ccccc1
InChIInChI=1S/C6H6N4O4.C6H6/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14;1-2-4-6-5-3-1/h1-3,8H,7H2;1-6H
InChIKeyMQZWBBHMYKPTSC-UHFFFAOYSA-N
XLogP2.48
TPSA124.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.25
LogP ≤ 52.48
H-Bond Donors ≤ 52
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

(2,4-dinitrophenyl)hydrazine;propan-2-one
CID 162068337
2-hydrazinyl-5-nitroaniline
CID 130769325
N'-(2,4-dinitrophenyl)methanediamine
CID 23597616
(2,4-dinitrophenyl)carbamic acid
CID 154114547
N-(2,4-dinitrophenyl)pyridin-1-ium-1-amine
CID 101076913
4-hydrazinyl-3-nitrobenzenethiol
CID 130955422
N-(2,4-dinitrophenyl)nitrous amide
CID 54504418
(2,4-dinitrophenyl)cyanamide
CID 12679048
(4-nitro-2-nitrosophenyl)hydrazine
CID 147552022
1-N-(2,4-dinitrophenyl)-2-methylpropane-1,2-diamine
CID 78954587
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one;(2,4-dinitrophenyl)hydrazine
CID 141450091
(2-methyl-5-nitrophenyl)hydrazine
CID 3918674

Frequently Asked Questions

What is the IUPAC name of benzene;(2,4-dinitrophenyl)hydrazine?
The IUPAC name of benzene;(2,4-dinitrophenyl)hydrazine (CID 159646359) is benzene;(2,4-dinitrophenyl)hydrazine.
What is the SMILES notation for benzene;(2,4-dinitrophenyl)hydrazine?
The canonical SMILES for benzene;(2,4-dinitrophenyl)hydrazine is NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].c1ccccc1.
What is the InChIKey of benzene;(2,4-dinitrophenyl)hydrazine?
The InChIKey is MQZWBBHMYKPTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O4.C6H6/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14;1-2-4-6-5-3-1/h1-3,8H,7H2;1-6H.
What are the key properties of benzene;(2,4-dinitrophenyl)hydrazine?
benzene;(2,4-dinitrophenyl)hydrazine has a molecular weight of 276.25 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;(2,4-dinitrophenyl)hydrazine is sourced from PubChem (CID 159646359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).