Thiazolidine (HCID 10444)

이름 및 식별자

우선 이름: Thiazolidine
IUPAC: 1,3-thiazolidine
영어명: Thiazolidine
분자식: C3H7NS
분자량: 89.16

이름 및 동의어

THIAZOLIDINE504-78-91,3-ThiazolidineTetrahydrothiazoleThiazolidinesI320806BKWNSC-357911CHEBI:50120DTXSID10198447RefChem:389315CHEBI:35622CHEBI:38333

이름 더 보기

Teneint-HRing ParentThiazolidine >Thiazolidine 95%Thiazolidine ,98%Cysteine Impurity 11

DTXCID40120938208-002-51-Thia-3-azacyclopentaneThiazole, tetrahydro-MFCD00005211CHEMBL1916078CCRIS 4275EINECS 208-002-5

데이터베이스 식별자

CAS: 504-78-9
PubChem CID: 10444
DTXSID: DTXSID10198447
ChEMBL: CHEMBL1916078
ChEBI: CHEBI:50120
UNII: I320806BKW
EC Number: 208-002-5
Nikkaji: J149.955F

물성

구조 계산 물성

XLogP: 0.3
극성 표면적: 37.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 5
형식 전하: 0
복잡도: 30

실험 및 물리화학적 성질

Kovats Retention Index · 2건

902；903；909

1460

물리화학적 성질

끓는 점: 72 · 72-75 °C/25 mmHg (lit.)
밀도: 1.131 g/mL · 1.131 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.5508(lit.)
인화점: 133 °F · 133 °F
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
용해도: 클로로포름(소량으로 용해), 메탄올(약간 용해됨)
산도 계수 (pKa): 8.84 · 8.84±0.20(Predicted)
물리적 상태: 액체
색상: 무색의
InChI: 1S/C3H7NS/c1-2-5-3-4-1/h4H,1-3H2
InChIKey: OGYGFUAIIOPWQD-UHFFFAOYSA-N
SMILES: C1CSCN1
LogP: -1.725 · -1.725 (est)

화학적 성질 · 1건

Thiazolidines are a class of hetrocyclic organic compounds having a 5 membered saturated ring with a thio ether group at 1 position and an amine group in the 3 position. It is sulfur analogue of oxazolidine. Thiazolidines may be synthesized by a condensation reaction between a thiol and an aldehyde or ketone. It is a reversible reaction. Therefore many thiazolidines are labile towards hydrolysis in aqueous solution. Hydrolysis of the thiazolidine generates the thiol and an aldehyde from which it was synthesized.

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H315 (10.4%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (10.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (10.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 3 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.