(2-bromo-4-methylsulfonylphenyl)hydrazine

C7H9BrN2O2S — CID 2761068

IUPAC(2-bromo-4-methylsulfonylphenyl)hydrazine
SMILESCS(=O)(=O)c1ccc(NN)c(Br)c1
InChIInChI=1S/C7H9BrN2O2S/c1-13(11,12)5-2-3-7(10-9)6(8)4-5/h2-4,10H,9H2,1H3
InChIKeyCCGWLSRTZZBNTG-UHFFFAOYSA-N
MW265.13 g/mol
LogP1.14
Rot. Bonds2

About (2-bromo-4-methylsulfonylphenyl)hydrazine

(2-bromo-4-methylsulfonylphenyl)hydrazine (PubChem CID 2761068) has the molecular formula C7H9BrN2O2S and a molecular weight of 265.13 g/mol. Its IUPAC name is (2-bromo-4-methylsulfonylphenyl)hydrazine.

Molecular Properties

Compound Name(2-bromo-4-methylsulfonylphenyl)hydrazine
PubChem CID2761068
Molecular FormulaC7H9BrN2O2S
Molecular Weight265.13 g/mol
Exact Mass263.96
IUPAC Name(2-bromo-4-methylsulfonylphenyl)hydrazine
SMILESCS(=O)(=O)c1ccc(NN)c(Br)c1
InChIInChI=1S/C7H9BrN2O2S/c1-13(11,12)5-2-3-7(10-9)6(8)4-5/h2-4,10H,9H2,1H3
InChIKeyCCGWLSRTZZBNTG-UHFFFAOYSA-N
XLogP1.14
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.13
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(4-methylsulfonyl-2-nitrophenyl)hydrazine
CID 3986701
2-bromo-N-(4-chlorophenyl)-4-methylsulfonylaniline
CID 118863483
1-N-(2-bromo-4-methylphenyl)-4-methylsulfonylbenzene-1,2-diamine
CID 43448020
3-bromo-4-(propan-2-ylamino)benzenesulfonamide
CID 43745736
2-(ethylamino)-5-methylsulfonylbenzenesulfonamide
CID 61036669
N-butan-2-yl-2-hydrazinyl-N-methyl-5-methylsulfonylbenzenesulfonamide
CID 43455184
(4-methylsulfonyl-2-thiomorpholin-4-ylsulfonylphenyl)hydrazine
CID 43455086
1-N-(4-bromo-2,6-dimethylphenyl)-4-methylsulfonylbenzene-1,2-diamine
CID 65467533
1-N-(3,5-dimethylphenyl)-4-methylsulfonylbenzene-1,2-diamine
CID 43448062
3-amino-4-(2-bromoanilino)-N-methylbenzenesulfonamide
CID 43449185
2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide
CID 102699204
1-N-(5-bromo-2-chlorophenyl)-4-methylsulfonylbenzene-1,2-diamine
CID 62914121

Frequently Asked Questions

What is the IUPAC name of (2-bromo-4-methylsulfonylphenyl)hydrazine?
The IUPAC name of (2-bromo-4-methylsulfonylphenyl)hydrazine (CID 2761068) is (2-bromo-4-methylsulfonylphenyl)hydrazine.
What is the SMILES notation for (2-bromo-4-methylsulfonylphenyl)hydrazine?
The canonical SMILES for (2-bromo-4-methylsulfonylphenyl)hydrazine is CS(=O)(=O)c1ccc(NN)c(Br)c1.
What is the InChIKey of (2-bromo-4-methylsulfonylphenyl)hydrazine?
The InChIKey is CCGWLSRTZZBNTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2O2S/c1-13(11,12)5-2-3-7(10-9)6(8)4-5/h2-4,10H,9H2,1H3.
What are the key properties of (2-bromo-4-methylsulfonylphenyl)hydrazine?
(2-bromo-4-methylsulfonylphenyl)hydrazine has a molecular weight of 265.13 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-4-methylsulfonylphenyl)hydrazine is sourced from PubChem (CID 2761068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).