Basic information
- CAS
5080-22-8- Standard SMILES
CC(C)NO- InChIKey
ODHYIQOBTIWVRZ-UHFFFAOYSA-N- Molecular formula
- C3H9NO
- Average molar mass
- 75.11 g/mol
- Monoisotopic mass
- 75.06841391
Names & identifiers
- Preferred name
- Isopropylhydroxylamine
- IUPAC
- N-propan-2-ylhydroxylamine
- English name
- N-Isopropylhydroxylamine
- Molecular formula
- C3H9NO
- Molecular weight
- 75.11
Names & synonyms
N-isopropylhydroxylamine5080-22-82-Propanamine, N-hydroxy-ISOPROPYLHYDROXYLAMINEDTXSID60636943NT440V34TRefChem:830194DTXCID0040913225-791-1N-propan-2-ylhydroxylaminen-hydroxypropan-2-amineMFCD02874394
Show more names
IPHAN-Isopropylhydroxylan-hydroxy-2-propanaminN-IsopropylhydroxyamineN-IsopropylhidroxylaMine
N-(propan-2-yl)hydroxylamineisopropyl hydroxylamine2-HydroxylaminopropaneN-HydroxyisopropylamineUNII-3NT440V34TN-HYDROXY-2-PROPANAMINEEINECS 225-791-1N-Isopropylhydroxylamine #
Database identifiers
- CAS
5080-22-8- PubChem CID
- 78763
- DTXSID
DTXSID6063694- ChEMBL
CHEMBL140282- UNII
- 3NT440V34T
- EC Number
- 225-791-1
- Nikkaji
- J203.284H
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 20.9
Experimental & physicochemical properties
Physical DescriptionLiquid
Physicochemical properties
- Melting point
- 159 · 159-160 °C (dec.)
- Boiling point
- 104.9 · 104.9±23.0 °C(Predicted)
- Density
- 0.886 · 0.886±0.06 g/cm3(Predicted)
- vapor pressure
- 68 Pa · 68Pa at 25℃
- pka
- 14.14 · 14.14±0.50(Predicted)
- Water Solubility
- 199 g/L · 199g/L at 25℃
- InChI
- InChI=1S/C3H9NO/c1-3(2)4-5/h3-5H,1-2H3
- InChIKey
- ODHYIQOBTIWVRZ-UHFFFAOYSA-N
- SMILES
- CC(NO)C
- LogP
- -0.574 at · -0.574 at 23℃
- FDA UNII
- 3 NT440V34T · 3NT440V34T
- EPA Substance Registry System
- 2 · 2-Propanamine, N-hydroxy- (5080-22-8)
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 2.3% (3 of 129) of reports.
Warning
H312 (28.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]
P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P317, P321, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 129 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
2-Propanamine, N-hydroxy- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propanamine, N-hydroxy- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 06-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/12650
2-Propanamine, N-hydroxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAcute Tox. 4 (28.7%)
Safety data
- tsca
- TSCA listed
- risk_code
- 21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 24/25
- Hazard statements
- H319-H315
- REACH Registrations
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 1,584,423 lb
Consumer UsesCorrosion inhibitor
Industry UsesProcessing aids not otherwise specified
General Manufacturing Information
Synthetic Rubber Manufacturing
2-Propanamine, N-hydroxy-: ACTIVE
Applications
UsesN-Isopropylhydroxylamine is used in preparation method of Methylstyrene Butadiene rubber.
Upstream & downstream products
Downstream products
Suppliers100 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
湖北鑫杰成化工科技有限公司13554075426 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
清宁生物（江苏博泉生物科技有限公司）
Related reactions
41 records
Compound notes
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