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Cystamine Dihydrochloride

HCID 5941
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기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
56-17-7
표준 SMILES
Cl.Cl.NCCSSCCN
InChIKey
YUFRRMZSSPQMOS-UHFFFAOYSA-N
분자식
C4H12N2S2.2ClH
평균 분자량
225.2 g/mol
단동위원소 질량
223.9975462

개요

See also: Cystamine (has active moiety).

이름 및 식별자

우선 이름
Cystamine Dihydrochloride
IUPAC
2-(2-aminoethyldisulfanyl)ethanamine;dihydrochloride
영어명
Cystamine dihydrochloride
분자식
C4H14Cl2N2S2
분자량
225.2

이름 및 동의어

Cystamine dihydrochloride56-17-7Cystamine HClCystamin dihydrochlorideEthanamine, 2,2'-dithiobis-, dihydrochlorideUSAF CB-342-Aminoethyl disulfide dihydrochloride2,2'-Dithiodi(ethylammonium) dichlorideBis(2-aminoethyl) disulfide dihydrochloride2,2'-Dithio-bis-(ethylamine) dihydrochlorideHydrochloride, CystamineI90T518457
이름 더 보기
aed2,2'-disulfanediyldiethanaMine dihydrochlorideusafcb-34CystamineHclcystaminedihclCystamine 2HClTIMTEC-BB SBB003325Cystamine dihydrochLCYSTAMINIUM DICHLORIDE
Dihydrochloride, CystamineDTXSID6058766NSC-39322C2U867X2F7NSC39322RefChem:130221DTXCID7042013200-260-7

데이터베이스 식별자

CAS
56-17-7
PubChem CID
5941
DTXSID
DTXSID6058766
ChEMBL
CHEMBL1256388、CHEMBL1594935
UNII
I90T518457
EC Number
200-260-7

물성

구조 계산 물성

극성 표면적
103 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
4
회전 가능 결합 수
5
무거운 원자 수
10
형식 전하
0
복잡도
37

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Sulfur Compounds
Physical DescriptionSolid; [Merck Index] White odorless hygroscopic powder; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
217 · 217-220 °C (dec.)(lit.)
저장 조건
30 °C · Store below +30°C.
용해도
2 O: · H2O: 가용성 1.0g/10mL, 투명~거의 투명, 무색~거의 무색(<5.5 NTU)
물리적 상태
결정질 분말, 결정 또는 덩어리
색상
흰색에서 노란색으로
생물학적 소스
synthetic
수용성
녹는
Merck
14 · 14,2776
BRN
3616850 · 3616850
안정성
안정적인. 강한 산화제와 호환되지 않습니다.
InChI
InChI=1S/C4H12N2S2.2ClH/c5-1-3-7-8-4-2-6;;/h1-6H2;2*1H
InChIKey
YUFRRMZSSPQMOS-UHFFFAOYSA-N
SMILES
S(CCN)SCCN.Cl.Cl
EPA
2 · Ethanamine, 2,2'-dithiobis-, dihydrochloride (56-17-7)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 53 reports by companies from 7 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 2건

Chemical: Ethanamine, 2,2'-dithiobis-, dihydrochloride

Ethanamine, 2,2'-dithiobis-, dihydrochloride: 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.

Hazards Summary · 1건

Causes depressed renal function tests in acute inhalation studies of rats; Causes somnolence, convulsions, and respiratory depression in oral lethal-dose studies of rats and mice; [RTECS] May cause irritation; Harmful by ingestion; [Alfa Aesar MSDS] See Cystamine.

Hazard Classes and CategoriesAcute Tox. 4 (100%)

독성 정보

Adverse EffectsNeurotoxin - Other CNS neurotoxin

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
KR7260000
HS 번호
29309070
risk_code
22-36/37/38
hazard_code
Xn
safety_code

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 3건

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

Drugs used to protect against ionizing radiation. They are usually of interest for use in radiation therapy but have been considered for other purposes, e.g. military.

Chemical agents that react with SH groups. This is a chemically diverse group that is used for a variety of purposes. Among these are enzyme inhibition, enzyme reactivation or protection, and labelling.

용도 및 제조

Uses · 1건

An anti-infective agent most commonly used in the treatment of urinary tract infections. Its anti-infective action derives from the slow release of formaldehyde by hydrolysis at acidic pH. (From Martindale, The Extra Pharmacopoeia, 30th ed, p173) [ChemIDplus]

Household ProductsInformation on 1 consumer products that contain Cystamine dihydrochloride in the following categories is provided:
General Manufacturing InformationEthanamine, 2,2'-dithiobis-, hydrochloride (1:2): ACTIVE
응용 분야 · 1건

용도Cystamine dihydrochloride acts as an anti-infective agent, which is used in the treatment of urinary tract infections. It is also used as a radiation-protective agent that interferes with sulfhydryl enzymes. Further, it serves as a heparin antagonist and sulfhydryl modifying reagent. In addition to this, it is used as an inhibitor of TGase.

상·하류 제품 정보

상류 원료

2-멜캅토에틸아민 수화염화물

관련 반응

9건
반응 기록 만들기
HRID 47253 반응식
HRID 47253반응물로uspto-grants-2004_03
HRID 63754 반응식
HRID 63754반응물로uspto-grants-2016_09
HRID 264794 반응식
HRID 264794반응물로uspto-grants-1997_07
HRID 436649 반응식
HRID 436649반응물로uspto-grants-1977_02
HRID 704545 반응식
HRID 704545반응물로uspto-grants-1991_01
HRID 1439626 반응식
HRID 1439626반응물로uspto-grants-1977_11
HRID 1439627 반응식
HRID 1439627반응물로uspto-grants-1977_11
HRID 1603190 반응식
HRID 1603190반응물로uspto-grants-1999_11
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화학적 성질

white powder

37/39-26-36/37/39
위험 등급
IRRITANT
Hazard Classifications
Acute Tox. 4 Oral
스토리지 클래스
11 - Combustible Solids

하류 제품

비스[2-(디메틸아미노)에틸]과황화물