1,4-Bis(3-aminopropyl)piperazine (HCID 81629)

이름 및 식별자

우선 이름: 1,4-Bis(3-aminopropyl)piperazine
IUPAC: 3-[4-(3-aminopropyl)piperazin-1-yl]propan-1-amine
현지명: 비스(아미노프로필)피페라진
영어명: 1,4-Bis(3-aminopropyl)piperazine
분자식: C10H24N4
분자량: 200.32

이름 및 동의어

1,4-Bis(3-aminopropyl)piperazineRefChem:4170327209-38-31,4-Piperazinedipropanamine3,3'-(Piperazine-1,4-diyl)bis(propan-1-amine)Bis(aminopropyl)piperazineN,N'-Bis(3-aminopropyl)piperazine3-[4-(3-aminopropyl)piperazin-1-yl]propan-1-amineMFCD00006161CCRIS 8915EINECS 230-589-1UNII-7GVX6C734B

이름 더 보기

비스(아미노프로필)피페라진1,4-피페라진다이프로파나민1,4-비스(아미노프로필)피페라진1,4-비스(3-아미노프로필)피페라진BAPPRZLABOTEST-BB LT00454560BIS AMINOPROPYL PIPIRAZINE1,4-PIPERAZINEBIS(PROPYLAMINE)1,4-(BIS AMINOPROPYL) PIPERAZINE

7GVX6C734BDTXSID8022246Piperazine, 1,4-bis(3-aminopropyl)-N,N'-Bis(p-aminopropyl)piperazine1,4-Bis(3-aminoprop-1-yl)piperazine1 pound not4-Bis(3-aminopropyl)piperazine1,4-Di(3-aminopropyl)piperazineBAPP

데이터베이스 식별자

CAS: 7209-38-3
PubChem CID: 81629
DTXSID: DTXSID8022246
ChEMBL: CHEMBL41307
UNII: 7GVX6C734B
EC Number: 230-589-1
Nikkaji: J2.148.520I、J35.447C

물성

구조 계산 물성

XLogP: -1.4
극성 표면적: 58.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 6
무거운 원자 수: 14
형식 전하: 0
복잡도: 116

실험 및 물리화학적 성질

Physical DescriptionLiquid

Collision Cross Section150.3 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID8022246]；150.2 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID8022246]

물리화학적 성질

녹는점: 15 °C · 15 °C(lit.)
끓는 점: 150 · 150-152 °C2 mm Hg(lit.)
밀도: 0.973 g/mL · 0.973 g/mL at 25 °C(lit.)
증기 밀도: 6.9 · 6.9 (vs air)
증기압: 0.133 Pa · 0.133Pa at 25℃
굴절률: 20 · n20/D 1.502(lit.)
인화점: 325 °F · 325 °F
저장 조건: 2 · 2-8°C, protect from light
물리적 상태: 투명한 액체
산도 계수 (pKa): 10.69 · 10.69±0.10(Predicted)
색상: 무색 내지 거의 무색
수소이온지수(pH): 11.7 at · 11.7 at 20℃ and 1mg/L
수용성: 물에 완전히 섞임.
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
표면장력: 39.96 mN/m · 39.96mN/m at 1g/L and 20℃
NIST: 1 · 1,4-Bis(3-aminopropyl)piperazine(7209-38-3)
EPA: 1 · 1,4-Piperazinedipropanamine (7209-38-3)

화학적 성질

colorless to yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

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.

유해성 정보

Regulatory Information · 5건

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 · 2건

Acute Tox. 4 (58.3%)；Skin Corr. 1B (100%)；Eye Dam. 1 (78.2%)；Aquatic Chronic 3 (58.3%)

Corrosives

규제 정보

Regulatory Information · 5건

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.)

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: TK8700000
ridadr: UN 2735 8/PG 2
독성: LD50 ivn-mus: 3500 mg/kg CPBTAL 20,2459,72
HS 번호: 2933599590
risk_code: 34
hazard_code: C
safety_code: 26-27-28-36/37/39-45
포장분류: II
위험 등급: 8
기존화학 물질: 2012-3-5576
Hazard Classifications: Eye Dam. 1Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

용도 및 제조

U.S. Production2023: 46,914 lb；2022: 50,684 lb；2021: 51,940 lb

Industry UsesAdhesion/cohesion promoter

General Manufacturing Information · 2건

Adhesive Manufacturing

1,4-Piperazinedipropanamine: ACTIVE

응용 분야

용도1,4-Bis(3-aminopropyl)piperazine was used to functionalize natural montmorillonite (M) and synthetic kanemite (K)1.

일반 설명The thermodynamic parameters for protonation of 1,4-bis(3-aminopropyl)-piperazine (BAPP) were studied in aqueous solution using a potentiometric technique.