Thiane

HCID 15367
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기본 정보

CAS
1613-51-0
표준 SMILES
C1CCSCC1
InChIKey
YPWFISCTZQNZAU-UHFFFAOYSA-N
분자식
C5H10S
평균 분자량
102.2 g/mol
단동위원소 질량
102.05032149

이름 및 식별자

우선 이름
Thiane
IUPAC
thiane
영어명
Thiane
분자식
C5H10S
분자량
102.2

이름 및 동의어

Thiane1613-51-0TetrahydrothiopyranPentamethylene sulfide2H-Thiopyran, tetrahydro-TETRAHYDRO-2H-THIOPYRANThiacyclohexanePenthiophaneTetrahydrothiapyran1413-51-0MFCD00006662P9BB3YF628
이름 더 보기
PENTAMETHYLENE SULPHIDE2H-Thiopyran,tetrahydro-
NSC-9459pentamethylenesulfidethiantetrahydro-thiopyranEINECS 216-561-1Pentamethylene sulfaneSCHEMBL3431UNII-P9BB3YF628

데이터베이스 식별자

CAS
1613-51-0
PubChem CID
15367
DTXSID
DTXSID60167108
UNII
P9BB3YF628
EC Number
216-561-1
Nikkaji
J7.531K

물성

구조 계산 물성

XLogP
1.7
극성 표면적
25.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
6

실험 및 물리화학적 성질

Vapor Pressure8.0 [mmHg]
Physical DescriptionColorless liquid with an unpleasant odor; [Alfa Aesar MSDS]
Kovats Retention Index · 2건

880；850；842；842；880

860

물리화학적 성질

녹는점
18.99 °C · 18.99°C
끓는 점
140 · 140-142°C
밀도
0 · 0,988 g/cm3
굴절률
1.506 · 1.5060
인화점
21 °C · 21°C
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 2 notifications to the ECHA C&L Inventory.；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 Information2H-Thiopyran, tetrahydro-: 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 SummaryMay cause irritation; [Alfa Aesar MSDS] See Diethyl sulfide and Tetrahydrothiophene.
Hazard Classes and CategoriesFlam. Liq. 2 (100%)

규제 정보

Regulatory Information2H-Thiopyran, tetrahydro-: 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.

안전 데이터

ridadr
1993
HS 번호
2934.99.9001
risk_code
10
safety_code
16-23-24/25
포장분류
II
위험 등급
3

화학 및 산업

응용 분야

용도It is a useful 5 c synthon for the synthesis of 3-cyclopentenones. It is a organic sulfide, that has shown to have antioxidant activity.

상·하류 제품 정보

공급사65 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
重庆欣博曜生物科技有限公司19122915778 · [email protected]

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