Basic information
- Standard SMILES
COCCCN- InChIKey
FAXDZWQIWUSWJH-UHFFFAOYSA-N- Molecular formula
- C4H11NO
- Average molar mass
- 89.14 g/mol
- Monoisotopic mass
- 89.08406397
Overview
structure in first source
Names & identifiers
- Preferred name
- 3-Methoxypropylamine
- IUPAC
- 3-methoxypropan-1-amine
- English name
- 3-Methoxypropylamine
- Molecular formula
- C4H11NO
- Molecular weight
- 89.14
Names & synonyms
Show more names
Database identifiers
- CAS
5332-73-0- PubChem CID
- 1672
- DTXSID
DTXSID7027596- ChEMBL
CHEMBL3186458- UNII
- VT819VO82Z
- EC Number
- 226-241-3
- Nikkaji
- J3.072D
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 23.5
Experimental & physicochemical properties
Chemical Classes
Nitrogen Compounds -> Other Nitrogen Compounds
Corrosives
Vapor Pressure
21.7 [mmHg]
20 [mm Hg] @30 °C
Physical Description
Liquid
Colorless liquid with an ammonia-like odor; [AIHA]
Physicochemical properties
- Melting point
- -65 °C · -65 °C
- Boiling point
- 117 · 117-118 °C/733 mmHg (lit.)
- Density
- 0.874 g/mL · 0.874 g/mL at 25 °C (lit.)
- vapor density
- 3.07 · 3.07 (vs air)
- vapor pressure
- 20 mm · 20 mm Hg ( 30 °C)
- refractive index
- 20 · n20/D 1.417(lit.)
- Flash point
- 73 °F · 73 °F
- storage temp.
- Flammables area
- form
- Liquid
- pka
- 9.73 · 9.73±0.10(Predicted)
- color
- Clear colorless to faintly colored
- PH
- 11.5 · 11.5 (100g/l, H2O, 20℃)
- explosive limit
- 2.3 · 2.3-12.3%(V)
- Viscosity
- 0.92 mm2/s · 0.92mm2/s
- Water Solubility
- miscible
- BRN
- 878144 · 878144
- Henry's Law Constant
- 2.1 · 2.1×101 mol/(m3Pa) at 25℃, Du et al. (2017)
- InChI
- 1S/C4H11NO/c1-6-4-2-3-5/h2-5H2,1H3
- InChIKey
- FAXDZWQIWUSWJH-UHFFFAOYSA-N
- SMILES
- COCCCN
- LogP
- -0.5 at · -0.5 at 25℃
- CAS DataBase Reference
- 5332 · 5332-73-0(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 819 VO82Z · VT819VO82Z
- NIST Chemistry Reference
- 1 · 1-Propanamine, 3-methoxy-(5332-73-0)
- EPA Substance Registry System
- 3 · 3-Methoxypropylamine (5332-73-0)
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 226 · H226-H290-H302-H314-H317
- Precautionary statements
- 210 · P210-P233-P280-P301+P312-P303+P361+P353-P305+P351+P338
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- C
- Risk Statements
- 10 · 10-34-35
- Safety Statements
- 26 · 26-36/37/39-45-16
- RIDADR
- 2734 · UN 2734 8/PG 2
- WGK Germany
- 1 · 1
- RTECS
- 3335000 · UI3335000
- Autoignition Temperature
- 518 °F · 518 °F
- TSCA
- TSCA listed
- HazardClass
- 8 · 8
- PackingGroup
- II
- HS Code
- 29221980 · 29221980
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Dam. 1Flam. Liq. 3Met. Corr. 1Skin Corr. 1ASkin Sens. 1
- REACH Registrations
- Active
- Limited Quantities
- 1 L · 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P333+P317, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 418 reports by companies from 15 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H226: Flammable liquid and vapor [Warning Flammable liquids]
Hazard information
Regulatory Information
Chemical: 1-Propanamine, 3-methoxy-
1-Propanamine, 3-methoxy- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanamine, 3-methoxy- 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)
Status: Active Update: 08-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13449
3-Methoxypropylamine: 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.)
Hazards Summary
Corrosive to skin; May cause skin sensitization; [eChemPortal: ERMA] A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis; May cause skin sensitization; [MSDSonline] WEEL basis is TLVs of other aliphatic amines to prevent eye and upper respiratory irritation; [AIHA]
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Flammable liquids - Category 3
Corrosives, Flammable agents - 3rd degree
Safety & protection
Protective Action Criteria (PAC)
15 [ppm]
170 [ppm]
990 [ppm]
Toxicology
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- UI3335000
- ridadr
- UN 2734 8/PG 2
- hs_code
- 29221980
- risk_code
- 10-34-35
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS07
- hazard_code
- C
- safety_code
- 26-36/37/39-45-16
- hazard_class
- 8
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H226-H290-H302-H314-H317
- Limited Quantities
- 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Flam. Liq. 3Met. Corr. 1Skin Corr. 1ASkin Sens. 1
- Autoignition Temperature
- 518 °F
- Precautionary statements
- P210-P233-P280-P301+P312-P303+P361+P353-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Oil and Gas Drilling, Extraction, and Support activities
1-Propanamine, 3-methoxy-: ACTIVE
Applications
UsesOrganic intermediate, emulsifier in anionic coatings and wax formulations.3-Methoxypropylamine (MOPA) is a liquid C3-Aminoether. It is used mainly as a corrosion inhibitor.
Upstream & downstream products
Downstream products
Suppliers50 total
Related reactions
Linked notes
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