Basic information
- CAS
216067-66-2- Standard SMILES
COc1ccc(CON)c(OC)c1- InChIKey
HNACNYOQQGUSRD-UHFFFAOYSA-N- Molecular formula
- C9H13NO3
- Average molar mass
- 183.2 g/mol
- Monoisotopic mass
- 183.08954328
Names & identifiers
- Preferred name
- O-(2,4-Dimethoxybenzyl)hydroxylamine
- IUPAC
- O-[(2,4-dimethoxyphenyl)methyl]hydroxylamine
- English name
- O-[(2,4-diMethoxyphenyl)Methyl]hydroxylaMine
- Molecular formula
- C9H13NO3
- Molecular weight
- 183.2
Names & synonyms
O-(2,4-Dimethoxybenzyl)hydroxylamine216067-66-2DTXSID80471658RefChem:366261DTXCID90422474827-154-9O-[(2,4-dimethoxyphenyl)methyl]hydroxylamineMFCD11594390SCHEMBL1883949HNACNYOQQGUSRD-UHFFFAOYSA-NRIA06766O-(24-Dimethoxybenzyl)hydroxylamine
Show more names
O-(2,4-Dimethoxybenzyl)2,4-DimethoxybenzyloxyaminehydrochlorideHydroxylamine, O-[(2,4-dimethoxyphenyl)methyl]-
AKOS006315494DS-6576O-(2,4-Dimethoxybenzyl)hydroxylamine)O-(2,4-Dimethoxy-benzyl)-hydroxylamineCS-0093863C74058EN300-1830784
Database identifiers
- CAS
216067-66-2- PubChem CID
- 11745274
- DTXSID
DTXSID80471658- EC Number
- 827-154-9
- Nikkaji
- J1.564.420F
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 53.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 143
Physicochemical properties
- Boiling point
- 321.6 · 321.6±32.0 °C(Predicted)
- Density
- 1.118 · 1.118
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 4.05 · 4.05±0.70(Predicted)
- Symbol(GHS)
- 2 · GHS02,GHS06,GHS07
- Signal word
- Danger
- Hazard statements
- 228 · H228-H301+H311+H331-H315-H319
- Precautionary statements
- 240 · P240-P210-P241-P280-P370+P378-P501-P261-P270-P271-P264-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P304+P340+P311-P403+P233-P405
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+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%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS06,GHS07
- Hazard statements
- H228-H301+H311+H331-H315-H319
- Precautionary statements
- P240-P210-P241-P280-P370+P378-P501-P261-P270-P271-P264-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P304+P340+P311-P403+P233-P405
Chemistry & industry
Suppliers29 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
Aladdin Scientific[email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
重庆科脉材料科技有限公司13370757113 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
郑州今斯孚化学有限公司0371-56635027 13838252817 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
上海鑫圭生物科技有限公司15121041756 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
上海中药创新研究中心86-21-50801717-301 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…