bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine

C19H17N3O5 — CID 67839586

IUPACbis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine
SMILESNNc1ccccc1[N+](=O)[O-].O=C(c1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C13H10O3.C6H7N3O2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;7-8-5-3-1-2-4-6(5)9(10)11/h1-8,14-15H;1-4,8H,7H2
InChIKeyIINXCOPSWUHPHU-UHFFFAOYSA-N
MW367.36 g/mol
LogP3.21
Rot. Bonds4

About bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine

bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine (PubChem CID 67839586) has the molecular formula C19H17N3O5 and a molecular weight of 367.36 g/mol. Its IUPAC name is bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine.

Molecular Properties

Compound Namebis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine
PubChem CID67839586
Molecular FormulaC19H17N3O5
Molecular Weight367.36 g/mol
Exact Mass367.12
IUPAC Namebis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine
SMILESNNc1ccccc1[N+](=O)[O-].O=C(c1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C13H10O3.C6H7N3O2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;7-8-5-3-1-2-4-6(5)9(10)11/h1-8,14-15H;1-4,8H,7H2
InChIKeyIINXCOPSWUHPHU-UHFFFAOYSA-N
XLogP3.21
TPSA138.72 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.36
LogP ≤ 53.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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

N'-(2-nitrophenyl)benzohydrazide
CID 3718054
4-[(2-nitroanilino)methyl]phenol
CID 43425831
[2-(2-nitroanilino)-2-oxoethyl] 4-benzoylbenzoate
CID 7204022
[4-[(4-hydroxyphenyl)methylamino]-3-nitrophenyl]-phenylmethanone
CID 47020734
1-(4-hydrazinyl-3-nitrophenyl)ethanone
CID 54491853
4-[2-(2-nitroanilino)ethyl]phenol
CID 47361180
(4-hydroxyphenyl)-phenylmethanone
CID 139062648
carbamic acid;N-methyl-2-nitroaniline
CID 175546963
(2-chlorophenyl)-[4-(2-nitroanilino)phenyl]methanone
CID 18358103
4-iodo-N-(2-nitrophenyl)benzamide
CID 2889506
[3-(4-hydroxybenzoyl)-5-nitrophenyl]-(4-hydroxyphenyl)methanone
CID 12070506
2-hydrazinyl-6-nitrobenzenethiol
CID 130775094

Frequently Asked Questions

What is the IUPAC name of bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine?
The IUPAC name of bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine (CID 67839586) is bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine.
What is the SMILES notation for bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine?
The canonical SMILES for bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine is NNc1ccccc1[N+](=O)[O-].O=C(c1ccc(O)cc1)c1ccc(O)cc1.
What is the InChIKey of bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine?
The InChIKey is IINXCOPSWUHPHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O3.C6H7N3O2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;7-8-5-3-1-2-4-6(5)9(10)11/h1-8,14-15H;1-4,8H,7H2.
What are the key properties of bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine?
bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine has a molecular weight of 367.36 g/mol, XLogP of 3.21, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-hydroxyphenyl)methanone;(2-nitrophenyl)hydrazine is sourced from PubChem (CID 67839586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).