CAS 51307-59-6 N-(4-Methoxybenzyl)hydroxylamine (HCID 10909770)

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Basic information

CAS: 51307-59-6
Standard SMILES: COc1ccc(CNO)cc1
InChIKey: CZPYPWDKUTWCHV-UHFFFAOYSA-N
Molecular formula: C8H11NO2
Average molar mass: 153.18 g/mol
Monoisotopic mass: 153.07897859

Names & identifiers

Preferred name: N-(4-Methoxybenzyl)hydroxylamine
IUPAC: N-[(4-methoxyphenyl)methyl]hydroxylamine
English name: N-(4-Methoxybenzyl)hydroxylaMine
Molecular formula: C8H11NO2
Molecular weight: 153.18

Names & synonyms

N-(4-Methoxybenzyl)hydroxylamine51307-59-6DTXSID30447964RefChem:362072DTXCID30398785N-[(4-methoxyphenyl)methyl]hydroxylamineMFCD23703122Benzenemethanamine, N-hydroxy-4-methoxy-p-methoxybenzylhydroxylamineSCHEMBL157282AKOS016011650DS-6917

Show more names

N-Hydroxy-4-methoxybenzylamineN-(4-methoxybenzyl)hydroxyamineN-(p-Methoxybenzyl)hydroxylamineN-hydroxy(4-methoxyphenyl)methanamine3-Pyridinecarbonitrile,6-bromo-6-methyl-N-(4-Methoxybenzyl)hydroxylamine - [M71588]

DA-42249N-Hydroxy-1-(4-methoxyphenyl)methanamineSY114024CS-0150387EN300-1842706F320817

Database identifiers

CAS: 51307-59-6
PubChem CID: 10909770
DTXSID: DTXSID30447964
Nikkaji: J1.735.273C

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 41.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 100

Physicochemical properties

Boiling point: 301.5 · 301.5±44.0 °C(Predicted)
Density: 1.125 · 1.125±0.06 g/cm3(Predicted)
storage temp.: -20 °C · Inert atmosphere,Store in freezer, under -20°C
pka: 13.26 · 13.26±0.30(Predicted)
Appearance: White to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313