트리 -n- 부틸 포스 핀 옥사이드

Tributylphosphine oxide

HCID 13138CAS 814-29-9

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCCCP(=O)(CCCC)CCCC
InChIKey: MNZAKDODWSQONA-UHFFFAOYSA-N
분자식: C12H27OP
평균 분자량: 218.32 g/mol
단동위원소 질량: 218.17995211

이름 및 식별자

우선 이름: Tributylphosphine oxide
IUPAC: 1-dibutylphosphorylbutane
현지명: 트리 -n- 부틸 포스 핀 옥사이드
영어명: Tri-n-butylphosphine oxide
분자식: C12H27OP
분자량: 218.32

이름 및 동의어

TRIBUTYLPHOSPHINE OXIDE814-29-9ButyphosPhosphine oxide, tributyl-Trisbutylphosphine oxideTributylfosfinoxidW58CDF8S4HNSC-41935NSC-65484DTXSID2061149RefChem:571882DTXCID5048217

이름 더 보기

트리-n-부틸포스핀옥사이드트리부틸포스핀산화물BUTYLPHOSNSC 65484NSC 41935HISHICOLIN PO-4tributylphane oxideOseltamivir impurity Htributyl-phosphineoxid

212-394-3Tri-n-butylphosphine oxide1-dibutylphosphorylbutaneTRI-N-BUTYLPHOSPHINEOXIDETBPOtributylphosphane oxide1-(dibutylphosphoryl)butaneMFCD00002082

데이터베이스 식별자

CAS: 814-29-9
PubChem CID: 13138
DTXSID: DTXSID2061149
UNII: W58CDF8S4H
EC Number: 212-394-3
Nikkaji: J50.218I

물성

구조 계산 물성

XLogP: 3.1
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 9
무거운 원자 수: 14
형식 전하: 0
복잡도: 137

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Phosphorus Compounds

SpringerMaterials PropertiesChemical shift

Physical DescriptionWhite crystalline powder; Hygroscopic; [Acros Organics MSDS]

물리화학적 성질

녹는점: 64 · 64-69 °C(lit.)
끓는 점: 150 °C1.5 · 150 °C1.5 mm Hg(lit.)
밀도: 0.848 g/cm3 · 0.8480 g/cm3
인화점: 150 °C/1mm · 150°C/1mm
저장 조건: 2 · 2-8°C
용해도: 55.7 g/L · 55.7g/L
물리적 상태: 고체
색상: 흰색에서 거의 흰색
수용성: 물에 용해됩니다(20°C에서 56g/L).
BRN: 1761977 · 1761977
InChI: InChI=1S/C12H27OP/c1-4-7-10-14(13,11-8-5-2)12-9-6-3/h4-12H2,1-3H3
InChIKey: MNZAKDODWSQONA-UHFFFAOYSA-N
SMILES: P(=O)(CCCC)(CCCC)CCCC
EPA: Tributylphosphine oxide (814-29-9)

화학적 성질

white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302+H312+H332 (69.5%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 151 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: Phosphine oxide, tributyl-

Phosphine oxide, tributyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA severe eye irritant; Intravenous LD50 (mouse) = 320 mg/kg; [RTECS] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Acros Organics MSDS] See Trioctylphosphine oxide. See Tributylphosphine.

Hazard Classes and CategoriesAcute Tox. 4 (96.7%)

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: SZ1575000
ridadr: UN 1759 8/PG 2
HS 번호: 29319090
risk_code: 20/21/22-34
hazard_code: C
safety_code: 26-27-28-36/37/39-45
포장분류: II
위험 등급: 8
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralSkin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 3건

Herbicides that remove leaves from trees and growing plants. They may be either organic or inorganic. Several of the more persistent types have been used in military operations and many are toxic. (From Hawley's Condensed Chemical Dictionary, 11th ed)

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.

Chemicals that, while not possessing inherent pesticidal activity, nonetheless promote or enhance the effectiveness of other pesticides when combined.