Basic information
- CAS
55556-93-9- Standard SMILES
O=NN1CCC(O)CC1- InChIKey
DLRQZSOHVPOGGS-UHFFFAOYSA-N- Molecular formula
- C5H10N2O2
- Average molar mass
- 130.15 g/mol
- Monoisotopic mass
- 130.07422757
Names & identifiers
- Preferred name
- 1-Nitroso-4-piperidinol
- IUPAC
- 1-nitrosopiperidin-4-ol
- English name
- N-nitroso-4-hydroxypiperidine
- Molecular formula
- C5H10N2O2
- Molecular weight
- 130.15
Names & synonyms
55556-93-9N-Nitroso-4-hydroxypiperidine1-Nitroso-4-piperidinol4-hydroxy-N-nitrosopiperidine18ZR821Q00DTXSID30204110RefChem:830828DTXCID301266011-nitrosopiperidin-4-olNitrosopiperidinolNitroso-4-piperidinolN-NITROSO-4-PIPERIDINOL
Show more names
4-Piperidinol, 1-nitroso-4-PIPERIDINOL, N-NITROSO-MFCD01699405BRN 1447942UNII-18ZR821Q001-Nitroso-piperidin-4-ol1-Nitroso-4-piperidinol #N-Nitroso-4-hydroxypiperidin
Database identifiers
- CAS
55556-93-9- PubChem CID
- 41471
- DTXSID
DTXSID30204110- ChEMBL
CHEMBL167695- UNII
- 18ZR821Q00
- EC Number
- 869-544-1
- Nikkaji
- J8.583I
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 99.1
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Nitrosamines
LogP-0.89
Vapor Pressure0.000225 [mmHg]
Physicochemical properties
- Boiling point
- 240.83 °C · 240.83°C (rough estimate)
- Density
- 1.2268 · 1.2268 (rough estimate)
- refractive index
- 1.4954 · 1.4954 (estimate)
- storage temp.
- 2 · 2-8°C, protect from light, stored under nitrogen
- pka
- 14.38 · 14.38±0.20(Predicted)
- Appearance
- Colorless to light yellow Liquid
- FDA UNII
- 18 ZR821Q00 · 18ZR821Q00
- Symbol(GHS)
- 8 · GHS08,GHS07
- Signal word
- Danger
- Hazard statements
- 350 · H350-H302-H332-H312
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
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P261, P264, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazards SummarySee NITROSAMINES.
Hazard Classes and CategoriesAcute Tox. 3 (50%)
Safety data
- Toxicity
- mma-sat 1 mmol/plate MUREAV 56,131,77
- Signal word
- Danger
- Symbol(GHS)
- GHS08,GHS07
- Hazard statements
- H350-H302-H332-H312
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
Chemistry & industry
Suppliers17 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
焦作沃恩生物科技有限责任公司0391-3702345 18739121806 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
济南路远生物医药科技有限公司13210587493 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
湖北摩科生物科技有限公司18274848843 · [email protected]
上海康满林生物医药有限公司68080707 15021879576 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
深圳市恒丰万达医药科技有限公司13986652530 · [email protected]
常州翔龙医药科技有限公司18661161657 · [email protected]
Related reactions
2 records
Compound notes
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