O-[(2-bromophenyl)methyl]hydroxylamine

C7H8BrNO — CID 2735422

IUPACO-[(2-bromophenyl)methyl]hydroxylamine
SMILESNOCc1ccccc1Br
InChIInChI=1S/C7H8BrNO/c8-7-4-2-1-3-6(7)5-10-9/h1-4H,5,9H2
InChIKeyNAROWIGYQNQXHL-UHFFFAOYSA-N
MW202.05 g/mol
LogP1.84
Rot. Bonds2

About O-[(2-bromophenyl)methyl]hydroxylamine

O-[(2-bromophenyl)methyl]hydroxylamine (PubChem CID 2735422) has the molecular formula C7H8BrNO and a molecular weight of 202.05 g/mol. Its IUPAC name is O-[(2-bromophenyl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(2-bromophenyl)methyl]hydroxylamine
PubChem CID2735422
Molecular FormulaC7H8BrNO
Molecular Weight202.05 g/mol
Exact Mass200.98
IUPAC NameO-[(2-bromophenyl)methyl]hydroxylamine
SMILESNOCc1ccccc1Br
InChIInChI=1S/C7H8BrNO/c8-7-4-2-1-3-6(7)5-10-9/h1-4H,5,9H2
InChIKeyNAROWIGYQNQXHL-UHFFFAOYSA-N
XLogP1.84
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.05
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Bromobenzyl alcohol
CID 70119
Benzyloxyamine hydrochloride
CID 102312
O-Benzylhydroxylamine
CID 102313
2-Bromobenzyl alcohol
CID 72850
3-Bromobenzyl alcohol
CID 85141
1-(2-Bromophenyl)ethanol
CID 95455
(2-Bromo-4-fluorophenyl)methanol
CID 2773347
O-(3-Bromobenzyl)hydroxylamine hydrochloride
CID 17750145
O-((3-Bromophenyl)(phenyl)methyl)hydroxylamine hydrochloride
CID 155540952
(R)-1-(2-bromophenyl)ethanol
CID 2734868
1-(2-Bromophenyl)ethan-1-ol
CID 6950331
4-Bromobenzyl methyl ether
CID 12662296

Frequently Asked Questions

What is the IUPAC name of O-[(2-bromophenyl)methyl]hydroxylamine?
The IUPAC name of O-[(2-bromophenyl)methyl]hydroxylamine (CID 2735422) is O-[(2-bromophenyl)methyl]hydroxylamine.
What is the SMILES notation for O-[(2-bromophenyl)methyl]hydroxylamine?
The canonical SMILES for O-[(2-bromophenyl)methyl]hydroxylamine is NOCc1ccccc1Br.
What is the InChIKey of O-[(2-bromophenyl)methyl]hydroxylamine?
The InChIKey is NAROWIGYQNQXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO/c8-7-4-2-1-3-6(7)5-10-9/h1-4H,5,9H2.
What are the key properties of O-[(2-bromophenyl)methyl]hydroxylamine?
O-[(2-bromophenyl)methyl]hydroxylamine has a molecular weight of 202.05 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(2-bromophenyl)methyl]hydroxylamine is sourced from PubChem (CID 2735422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).