Naphazoline Nitrate
Basic information
- CAS
10061-11-7- Standard SMILES
O=[N+]([O-])O.c1ccc2c(CC3=NCCN3)cccc2c1- InChIKey
ZAHXYMFVNNUHCP-UHFFFAOYSA-N- Molecular formula
- C14H14N2.HNO3
- Average molar mass
- 273.29 g/mol
- Monoisotopic mass
- 273.11134135
Overview
Naphazoline nitrate is a member of naphthalenes.
Names & identifiers
- Preferred name
- Naphazoline Nitrate
- IUPAC
- 2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole;nitric acid
- English name
- Naphazoline nitrate
- Molecular formula
- C14H15N3O3
- Molecular weight
- 273.29
Names & synonyms
Naphazoline nitrate5144-52-5BenilVistalbalonClera2-(1-Naphthylmethyl)-2-Imidazoline Nitrate1H-Imidazole, 4,5-dihydro-2-(1-naphthalenylmethyl)-, mononitrateSC99GR1T5S2-IMIDAZOLINE, 2-(1-NAPHTHYLMETHYL)-, MONONITRATENitrate, Naphazoline2-(NAPHTHALEN-1-YLMETHYL)-4,5-DIHYDRO-1H-IMIDAZOLE MONONITRATERefChem:831726
Show more names
rinazinPrivinanaftizinNaphazoLnaphtyzinnaphthisennaphthizenine nitrateprivinenitratephazoline nitrate
225-915-4NaphconNaphazoline (nitrate)4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrateMFCD00014316Naphazoline nitrate [JAN]2-(Naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole nitrate2-[1-Naphthylmethyl]imidazoline
Database identifiers
- CAS
10061-11-7、5144-52-5- PubChem CID
- 82332
- DTXSID
DTXSID60863496- ChEBI
CHEBI:7471- UNII
- SC99GR1T5S
- EC Number
- 225-915-4、233-197-9
Properties
Computed structural properties
- Topological polar surface area
- 90.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 297
Physicochemical properties
- Melting point
- 167 · 167-170 °C
- storage temp.
- 2 · 2-8°C
- solubility
- Sparingly soluble in water, soluble in ethanol (96 per cent).
- form
- Solid
- color
- White to off-white
- Sensitive
- Hygroscopic
- BRN
- 3779329 · 3779329
- Major Application
- pharmaceutical (small molecule)
- InChI
- InChI=1S/C14H14N2.HNO3/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14;2-1(3)4/h1-7H,8-10H2,(H,15,16);(H,2,3,4)
- InChIKey
- ZAHXYMFVNNUHCP-UHFFFAOYSA-N
- SMILES
- C12C(C=CC=C1)=CC=CC=2CC1=NCCN1.[N+]([O-])(=O)O
- CAS DataBase Reference
- 5144 · 5144-52-5(CAS DataBase Reference)
- FDA UNII
- 99 GR1T5S · SC99GR1T5S
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 46 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 1H-Imidazole, 4,5-dihydro-2-(1-naphthalenylmethyl)-, mononitrate
Naphazoline nitrate: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 1H-Imidazole, 4,5-dihydro-2-(1-naphthalenylmethyl)-, mononitrate: Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- F
- 3-10
- wgk
- 3
- rtecs
- NJ4376000
- ridadr
- 3249
- hs_code
- 29332900
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 22-36/37-60-36
- hazard_class
- 6.1(b)
- Storage Class
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Drugs that selectively bind to and activate alpha adrenergic receptors.
Drugs designed to treat inflammation of the nasal passages, generally the result of an infection (more often than not the common cold) or an allergy related condition, e.g., hay fever. The inflammation involves swelling of the mucous membrane that lines the nasal passages and results in inordinate mucus production. The primary class of nasal decongestants are vasoconstrictor agents. (From PharmAssist, The Family Guide to Health and Medicine, 1993)
Applications
Usesantihistamine
Upstream & downstream products
Upstream raw materials
Downstream products
Additional notes
DefinitionChEBI: Naphazoline nitrate is a member of naphthalenes.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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