Basic information
- CAS
1095269-04-7- Standard SMILES
CCCI- InChIKey
PVWOIHVRPOBWPI-UHFFFAOYSA-N- Molecular formula
- C3H7I
- Average molar mass
- 169.99 g/mol
Overview
Iodopropanes appears as a colorless liquid that discolors in air. Denser than water. The vapors are heavier than air. May be mildly toxic by inhalation. Used as a solvent and to make pharmaceuticals.
Names & identifiers
- Preferred name
- 1-Iodopropane
- IUPAC
- 1-iodopropane
- English name
- 1-Iodopropane-2,2,3,3,3-d5 (stabilized with copper)
- Molecular formula
- C3H7I
- Molecular weight
- 169.99
Names & synonyms
1-IODOPROPANE107-08-4Propyl iodidePropane, 1-iodo-ND3629KE2KDTXSID501015653RefChem:869737DTXCID3037595203-460-2n-Propyl iodidePropane, iodo-1-iodo-propane
Show more names
1-Iodopropane-2,2,3,3,3-d5 (stabilized with copper)
IODOPROPANE1-Jodpropan26914-02-3MFCD00001095PROPYLIODIDE1-Jodpropan [Czech]Propane Iodide; Propyl Iodide; n-Propyl Iodideiodopropan
Database identifiers
- CAS
1095269-04-7- UNII
- ND3629KE2K
- EC Number
- 203-460-2
- Nikkaji
- J4.051G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 4
- Formal charge
- 0
- Complexity
- 7.2
Experimental & physicochemical properties
Chemical Classes
Other Classes -> Halogenated Aliphatics, Saturated
Flammable agents - 2nd degree
SpringerMaterials PropertiesCoriolis coupling
LogP2.54
Vapor Pressure43.1 [mmHg]
Physical Description
Iodopropanes appears as a colorless liquid that discolors in air. Denser than water. The vapors are heavier than air. May be mildly toxic by inhalation. Used as a solvent and to make pharmaceuticals.
Colorless or yellowish liquid; [Merck Index]
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 50 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Propane, 1-iodo-
Status: Active Update: 01-02-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22093
1-Iodopropane: Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelFlammable Liquid
Fire HazardsExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Health HazardsExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Hazards SummaryAn irritant; Harmful by inhalation; [Alfa Aesar MSDS]
Reactive GroupHalogenated Organic Compounds
Reactivity AlertsHighly Flammable
Reactivity Profile
Halogenated aliphatic compounds, such as IODOPROPANE, are moderately or very reactive. Halogenated organics generally become less reactive as more of their hydrogen atoms are replaced with halogen atoms. Low molecular weight haloalkanes are highly flammable and can react with some metals to form dangerous products. Materials in this group are incompatible with strong oxidizing and reducing agents. Also, they are incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides.
Air and Water ReactionsHighly flammable. Slightly soluble in water.
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Flammable agents - 2nd degree
Safety & protection
Fire FightingExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
First AidExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Nonfire Spill ResponseExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Isolation and EvacuationExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Toxicology
Toxicity DataLC50 (rat) = 73,000 mg/m3/30min
Chemistry & industry
Pharmacology
Metabolism/Metabolites1-iodopropane has known human metabolites that include propyl-glutathione.
Uses & manufacturing
General Manufacturing InformationPropane, 1-iodo-: ACTIVE
Applications
Uses1-Iodopropane-2,2,3,3,3-d5 (CAS# 1095269-04-7) is a useful isotopically labeled research compound.
Suppliers5 total
盐城通铭生物科技有限公司15195160625 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
玺标（上海）科技有限公司18512111473 18512111473 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
上海葑菲医药科技有限公司+8618221552033 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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