O-[(4-chlorophenyl)methyl]hydroxylamine

HCID 217574

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Basic information

CAS: 5555-51-1
Standard SMILES: NOCc1ccc(Cl)cc1
InChIKey: GONDHKVGJCQJPR-UHFFFAOYSA-N
Molecular formula: C7H8ClNO
Average molar mass: 157.6 g/mol
Monoisotopic mass: 157.0294416

Names & identifiers

Preferred name: O-[(4-chlorophenyl)methyl]hydroxylamine
IUPAC: O-[(4-chlorophenyl)methyl]hydroxylamine
English name: 1-[(AMINOOXY)METHYL]-4-CHLOROBENZENE
Molecular formula: C7H8ClNO
Molecular weight: 157.6

Names & synonyms

5555-51-1O-[(4-chlorophenyl)methyl]hydroxylamineO-((4-Chlorophenyl)methyl)hydroxylamineRefChem:855063879-052-91-[(Aminooxy)methyl]-4-chlorobenzeneO-(4-chlorobenzyl)hydroxylamineHydroxylamine, O-[(4-chlorophenyl)methyl]-MFCD04230620CHEMBL3764023SCHEMBL1520291SCHEMBL8716806

Show more names

(4-chlorobenzyl)oxyamine-[(aminooxy)methyl]-4-chlorobenzene1-[(aminooxy)methyl]-4-chlorobenzene(SALTDATA: FREE)

CHEMBL3765978SCHEMBL11167734DTXSID50902722GONDHKVGJCQJPR-UHFFFAOYSA-NFAA55551BDBM50146529EBC-44094AKOS000353333

Database identifiers

CAS: 5555-51-1
PubChem CID: 217574
DTXSID: DTXSID50902722
ChEMBL: CHEMBL3764023、CHEMBL3765978
EC Number: 879-052-9
Nikkaji: J238.973H

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 35.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 91

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H335-H302-H319-H312-H332
Precautionary statements: 264 · P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H335-H302-H319-H312-H332
Precautionary statements: P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P