Basic information
- Standard SMILES
NCCCN1CCN(CCCN)CC1- InChIKey
XUSNPFGLKGCWGN-UHFFFAOYSA-N- Molecular formula
- C10H24N4
- Average molar mass
- 200.32 g/mol
- Monoisotopic mass
- 200.20009678
Names & identifiers
- Preferred name
- 1,4-Bis(3-aminopropyl)piperazine
- IUPAC
- 3-[4-(3-aminopropyl)piperazin-1-yl]propan-1-amine
- English name
- 1,4-Bis(3-aminopropyl)piperazine
- Molecular formula
- C10H24N4
- Molecular weight
- 200.32
Names & synonyms
Show more names
Database identifiers
- CAS
7209-38-3- PubChem CID
- 81629
- DTXSID
DTXSID8022246- ChEMBL
CHEMBL41307- UNII
- 7GVX6C734B
- EC Number
- 230-589-1
- Nikkaji
- J2.148.520I、J35.447C
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 58.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 116
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 15 °C · 15 °C(lit.)
- Boiling point
- 150 · 150-152 °C2 mm Hg(lit.)
- Density
- 0.973 g/mL · 0.973 g/mL at 25 °C(lit.)
- vapor density
- 6.9 · 6.9 (vs air)
- vapor pressure
- 0.133 Pa · 0.133Pa at 25℃
- refractive index
- 20 · n20/D 1.502(lit.)
- Flash point
- 325 °F · 325 °F
- storage temp.
- 2 · 2-8°C, protect from light
- form
- clear liquid
- pka
- 10.69 · 10.69±0.10(Predicted)
- color
- Colorless to Almost colorless
- PH
- 11.7 at · 11.7 at 20℃ and 1mg/L
- Water Solubility
- Fully miscible in water.
- Sensitive
- Air Sensitive
- BRN
- 111747 · 111747
- InChI
- 1S/C10H24N4/c11-3-1-5-13-7-9-14(10-8-13)6-2-4-12/h1-12H2
- InChIKey
- XUSNPFGLKGCWGN-UHFFFAOYSA-N
- SMILES
- NCCCN1CCN(CCCN)CC1
- LogP
- -1.43 at · -1.43 at 25℃ and pH12.5
- Surface tension
- 39.96 mN/m · 39.96mN/m at 1g/L and 20℃
- CAS DataBase Reference
- 7209 · 7209-38-3(CAS DataBase Reference)
- FDA UNII
- 7 GVX6C734B · 7GVX6C734B
- NIST Chemistry Reference
- 1 · 1,4-Bis(3-aminopropyl)piperazine(7209-38-3)
- EPA Substance Registry System
- 1 · 1,4-Piperazinedipropanamine (7209-38-3)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 280 · P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-27-28-36/37/39-45
- RIDADR
- 2735 · UN 2735 8/PG 2
- WGK Germany
- 3 · 3
- RTECS
- 8700000 · TK8700000
- TSCA
- TSCA listed
- HazardClass
- 8 · 8
- PackingGroup
- II
- HS Code
- 2933599590 · 2933599590
- Storage Class
- 8 A · 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- 1 Skin · Eye Dam. 1Skin Corr. 1B
- Toxicity
- 50 ivn-mus: · LD50 ivn-mus: 3500 mg/kg CPBTAL 20,2459,72
- 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
H302 (58.3%): Harmful if swallowed [Warning Acute toxicity, oral];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H318 (78.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H412 (58.3%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 206 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory Information
Chemical: 1,4-Piperazinedipropanamine;Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.
1,4-Piperazinedipropanamine is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Piperazinedipropanamine 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: 19-08-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/21266
1,4-Bis(3-aminopropyl)piperazine: 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.
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.)
Hazard Classes and Categories
Acute Tox. 4 (58.3%);Skin Corr. 1B (100%);Eye Dam. 1 (78.2%);Aquatic Chronic 3 (58.3%)
Corrosives
Regulatory information
Regulatory Information
Chemical: 1,4-Piperazinedipropanamine;Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.
1,4-Piperazinedipropanamine is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Piperazinedipropanamine 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: 19-08-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/21266
1,4-Bis(3-aminopropyl)piperazine: 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.
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.)
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- TK8700000
- ridadr
- UN 2735 8/PG 2
- hs_code
- 2933599590
- Toxicity
- LD50 ivn-mus: 3500 mg/kg CPBTAL 20,2459,72
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-27-28-36/37/39-45
- hazard_class
- 8
- Storage Class
- 8A - Combustible corrosive hazardous materials
- packing_group
- II
- Hazard statements
- H314
- 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
- Eye Dam. 1Skin Corr. 1B
- Precautionary statements
- P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Adhesive Manufacturing
1,4-Piperazinedipropanamine: ACTIVE
Applications
Uses1,4-Bis(3-aminopropyl)piperazine was used to functionalize natural montmorillonite (M) and synthetic kanemite (K)1.
General DescriptionThe thermodynamic parameters for protonation of 1,4-bis(3-aminopropyl)-piperazine (BAPP) were studied in aqueous solution using a potentiometric technique.
Upstream & downstream products
Upstream raw materials
Suppliers50 total
Related reactions
Linked notes
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