(3-bromophenyl)-(2-methylphenyl)diazene

C13H11BrN2 — CID 563793

IUPAC(3-bromophenyl)-(2-methylphenyl)diazene
SMILESCc1ccccc1/N=N/c1cccc(Br)c1
InChIInChI=1S/C13H11BrN2/c1-10-5-2-3-8-13(10)16-15-12-7-4-6-11(14)9-12/h2-9H,1H3/b16-15+
InChIKeyOINVRVSDZLHRHF-FOCLMDBBSA-N
MW275.15 g/mol
LogP5.17
Rot. Bonds2

About (3-bromophenyl)-(2-methylphenyl)diazene

(3-bromophenyl)-(2-methylphenyl)diazene (PubChem CID 563793) has the molecular formula C13H11BrN2 and a molecular weight of 275.15 g/mol. Its IUPAC name is (3-bromophenyl)-(2-methylphenyl)diazene.

Molecular Properties

Compound Name(3-bromophenyl)-(2-methylphenyl)diazene
PubChem CID563793
Molecular FormulaC13H11BrN2
Molecular Weight275.15 g/mol
Exact Mass274.01
IUPAC Name(3-bromophenyl)-(2-methylphenyl)diazene
SMILESCc1ccccc1/N=N/c1cccc(Br)c1
InChIInChI=1S/C13H11BrN2/c1-10-5-2-3-8-13(10)16-15-12-7-4-6-11(14)9-12/h2-9H,1H3/b16-15+
InChIKeyOINVRVSDZLHRHF-FOCLMDBBSA-N
XLogP5.17
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.15
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

(3-bromophenyl)-(2-iodophenyl)diazene
CID 142736144
ethane;(2-methylphenyl)-phenyldiazene;propane
CID 143988882
2,6-dimethyl-4-[(2-methylphenyl)diazenyl]phenol
CID 137240605
N-(3-bromophenyl)iminomethanesulfonamide
CID 162405145
4-[(3-bromophenyl)diazenyl]naphthalen-2-ol
CID 21238074
(4-diazenyl-3-methylphenyl)-(2-methylphenyl)diazene
CID 4196526
N-[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]formamide
CID 58958294
5-[(3-bromophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
CID 4194807
(3-bromophenyl)-[4-(trifluoromethyl)phenyl]diazene
CID 86246481
1-(aminodiazenyl)-2-methylbenzene
CID 21467423
4,5-dimethyl-2-phenyldiazenylaniline
CID 88743909
hydrogen sulfate;[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]iminoazanium
CID 51063117

Frequently Asked Questions

What is the IUPAC name of (3-bromophenyl)-(2-methylphenyl)diazene?
The IUPAC name of (3-bromophenyl)-(2-methylphenyl)diazene (CID 563793) is (3-bromophenyl)-(2-methylphenyl)diazene.
What is the SMILES notation for (3-bromophenyl)-(2-methylphenyl)diazene?
The canonical SMILES for (3-bromophenyl)-(2-methylphenyl)diazene is Cc1ccccc1/N=N/c1cccc(Br)c1.
What is the InChIKey of (3-bromophenyl)-(2-methylphenyl)diazene?
The InChIKey is OINVRVSDZLHRHF-FOCLMDBBSA-N. The full InChI is InChI=1S/C13H11BrN2/c1-10-5-2-3-8-13(10)16-15-12-7-4-6-11(14)9-12/h2-9H,1H3/b16-15+.
What are the key properties of (3-bromophenyl)-(2-methylphenyl)diazene?
(3-bromophenyl)-(2-methylphenyl)diazene has a molecular weight of 275.15 g/mol, XLogP of 5.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromophenyl)-(2-methylphenyl)diazene is sourced from PubChem (CID 563793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).