Sulfur trioxide triethylamine complex

HCID 222301CAS 761-01-3

기본 정보

표준 SMILES: CCN(CC)CC.O=S(=O)=O
InChIKey: YYHPEVZFVMVUNJ-UHFFFAOYSA-N
분자식: C6H15NO3S
평균 분자량: 181.26 g/mol
단동위원소 질량: 181.07726434

이름 및 식별자

우선 이름: Sulfur trioxide triethylamine complex
IUPAC: N,N-diethylethanamine;sulfur trioxide
영어명: Sulfur trioxide-triethylamine complex
분자식: C6H15N.O3S
분자량: 181.25

이름 및 동의어

DTXSID90278539RefChem:1099228DTXCID40229697761-01-3N,N-diethylethanamine;sulfur trioxideMFCD00043315N,N-diethylethanamine; sulfur trioxideNSC8168NSC 8168NSC 68185Et3N.SO3triethylamine sulphur trioxide

이름 더 보기

TriethylAmine Sulfur Trioxidefur trioxide triethyLTriethylammonium trioxide copolymerTRIETHYLAMINE-SULFUR TRIOXIDE COMPLEXSulfur trioxide-triethylamine complexsulfurtrioxidetriethylaminecomplex95+%N,N-diethylethanamine - oxosulfane dioxide (1:1)

SCHEMBL284131orb3023441NSC-8168NSC68185NSC-68185TN9579N,N-Diethylethanamine sulfur trioxideFS61304

데이터베이스 식별자

CAS: 761-01-3
PubChem CID: 222301
DTXSID: DTXSID90278539
EC Number: 629-333-5

물성

구조 계산 물성

극성 표면적: 55.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 11
형식 전하: 0
복잡도: 87.5

물리화학적 성질

녹는점: 85 °C · ~85 °C
저장 조건: 2 · 2-8°C
용해도: 클로로포름(약간 용해됨), 에틸아세테이트(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: powder to crystal
색상: White to Light yellow to Light orange
BRN: 3993165 · 3993165
InChI: InChI=1S/C6H15N.O3S/c1-4-7(5-2)6-3;1-4(2)3/h4-6H2,1-3H3;
InChIKey: YYHPEVZFVMVUNJ-UHFFFAOYSA-N
SMILES: S(=O)(=O)=O.N(CC)(CC)CC

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

wgk: 3
ridadr: UN 3261 8/PG 2
HS 번호: 29211990
risk_code: 34
hazard_code: C
safety_code: 26-36/37/39-45
포장분류: II
위험 등급: 8
F 고인화성물질: 3-10-21

화학 및 산업

응용 분야 · 1건

용도Reactant for reagent for synthesis of:Anticoagulant and antiplatelet persulfated glycosides or flavonoids containing an oligopolysulfated moietyNarciclasine derivatives for use as anticancer agentsSulfate-conjugated methylprednisolone for use as a colon-specific prodrugTetrasaccharide substrates of heparanase by glycosylation of disaccharidesSynthetic heparin oligosaccharide microarrays for analysis of heparin-protein interactionsDexamethasone 21-sulfate sodium for use as a colon-specific prodrug

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

杭州品高化工有限公司0571-87658025 · [email protected]

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