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3-Methoxypropylamine

HCID 1672
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5332-73-0
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

3-Methoxypropylamine5332-73-01-Amino-3-methoxypropane1-Propanamine, 3-methoxy-Propylamine, 3-methoxy-Propanolamine methyl ethergamma-MethoxypropylamineDTXSID70275963MOPA cpdVT819VO82ZNSC-552DTXCID807596
Show more names
MOPAmPPG1-NH2(1,3)FENTAMINE OPA-13-MethoxypropyLRARECHEM AL BW 00733-methoxy-propylaminMethoxy-3-propylamine
RefChem:503292226-241-33-methoxypropan-1-amine3-Aminopropyl methyl ether3-Methoxy-1-propanamine3-Methyoxypropylamine3-MPA3-Methoxy-n-propylamine

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 · 2 items

Nitrogen Compounds -> Other Nitrogen Compounds

Corrosives

SpringerMaterials PropertiesBoiling point
Density0.8615 @ 20°C
Boiling Point117.5 °C @760 [mm Hg]
Melting Point-75.7 °C
Odor ThresholdOdor Threshold Low: 0.2 [ppm]
Vapor Pressure · 2 items

21.7 [mmHg]

20 [mm Hg] @30 °C

Physical Description · 2 items

Liquid

Colorless liquid with an ammonia-like odor; [AIHA]

Physicochemical properties

Melting point
-65 °C · -65 °C

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 · 6 items

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 · 5 items

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 · 1 item

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]

Chemistry & industry

Uses & manufacturing

UsesUsed in steam systems as a corrosion inhibitor and to make soaps and emulsions in floor coatings, textile finishes, and paints; [AIHA]
U.S. Production2023: 1,000,000 - <8,500,000 lb
Industry UsesAnti-scaling agent
Household ProductsInformation on 1 consumer products that contain 3-Methoxypropylamine in the following categories is provided:
General Manufacturing Information · 2 items

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

Coumarin 6Disperse Blue 6010-(2-Benzothiazolyl)-2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-1H,5H,11H-(1)benzopyropyrano(6,7-8-I,j)quinolizin-11-onecis-Aconitic acidDISPERSE BLUE 87Disperse Red 221

Related reactions

260 records
New reaction record
HRID 9391 reaction equation
HRID 9391As reactantuspto-grants-2006_08
HRID 12339 reaction equation
HRID 12339As reactantuspto-grants-2010_06
HRID 12356 reaction equation
HRID 12356As reactantuspto-grants-2010_06
HRID 23892 reaction equation
HRID 23892As reactantuspto-grants-2005_02
HRID 23894 reaction equation
HRID 23894As reactantuspto-grants-2005_02
HRID 23895 reaction equation
HRID 23895As reactantuspto-grants-2005_02
HRID 34898 reaction equation
HRID 34898As reactantuspto-grants-1988_08
HRID 42315 reaction equation
HRID 42315As reactantuspto-grants-2013_09
Page 1 of 33

Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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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)
Hazard Classes and Categories · 3 items

Flam. Liq. 3 (100%)

Flammable liquids - Category 3

Corrosives, Flammable agents - 3rd degree

Safety & protection

Protective Action Criteria (PAC) · 3 items

15 [ppm]

170 [ppm]

990 [ppm]

Toxicology

Adverse EffectsDermatotoxin - Skin burns.
Toxicity DataLC (rat) = 11,500 ppm/6H (2/3 deaths in 1 day);

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
C.I. Disperse Yellow 58
Disperse Yellow 63
Disperse Blue 60
Disperse Orange 32
2-Cyano-N-(3-methoxy-propyl)-acetamide
1-Propanamine, 3-methoxy-N-(phenylmethylene)-
2-Propyn-1-amine,N-(2-methoxyethyl)-N-methyl-(9CI)
3-(3-Methoxypropyl)-1-phenylthiourea