기본 정보
- CAS
2044-73-7- 표준 SMILES
SCc1ccccn1- InChIKey
SJIIDWBFRZACDQ-UHFFFAOYSA-N- 분자식
- C6H7NS
- 평균 분자량
- 125.19 g/mol
- 단동위원소 질량
- 125.02992022
이름 및 식별자
- 우선 이름
- 2-Pyridinemethanethiol
- IUPAC
- pyridin-2-ylmethanethiol
- 영어명
- 2-Pyridinemethanethiol
- 분자식
- C6H7NS
- 분자량
- 125.19
이름 및 동의어
2-Pyridinemethanethiol2044-73-7pyridin-2-ylmethanethiol2-Picolylthiol2-PyridinylmethanethiolPyridine-2-thiocarbinol2-Pyridylmethyl mercaptan2-(Mercaptomethyl)pyridine2-Pyridinylmethyl mercaptanFEMA No. 3232UNII-PB9B741VC3EINECS 218-061-9
이름 더 보기
FEMA 3232FEMA NUMBER 3232PYRIDINE-2-METHANETHIOL2-pyridylmethylmercaptan2-MERCAPTOMETHYL PYRIDINE
NSC 823202-PYRIDINE METHANETHIOLPB9B741VC3BRN 01078532-pyridinyl methane thiolNSC-823205-21-02-00161 (Beilstein Handbook Reference)DTXSID6062127
데이터베이스 식별자
- CAS
2044-73-7- PubChem CID
- 256071
- DTXSID
DTXSID6062127- UNII
- PB9B741VC3
- EC Number
- 218-061-9
- Nikkaji
- J52.346A
물성
구조 계산 물성
- XLogP
- 1
- 극성 표면적
- 13.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 8
- 형식 전하
- 0
- 복잡도
- 65.5
실험 및 물리화학적 성질
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density1.150-1.157
Flavoring AgentsEU Flavoring substances
SolubilitySoluble (in ethanol)
Boiling Point
57.00 to 58.00 °C. @ 0.60 mm Hg
57-58 °C (0.6 mm Hg)
Refractive Index1.573-1.580
Physical DescriptionColourless to yellow liquid; Pungent sulferous aroma
물리화학적 성질
- 끓는 점
- 234 °C · 234°C (estimate)
- 밀도
- 1.136 · 1.136 (estimate)
- 굴절률
- 1.4606 · 1.4606 (estimate)
- FEMA
- 3232 · 3232 | 2-PYRIDINEMETHANETHIOL
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 산도 계수 (pKa)
- 8.93 · 8.93±0.10(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (98.9%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 91 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 2-Pyridinemethanethiol
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
2-Pyridinemethanethiol: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesSkin Irrit. 2 (98.9%)
안전 데이터
- tsca
- TSCA listed
- HS 번호
- 2933399990
화학 및 산업
약리 정보
Cellular LocationsCytoplasm
용도 및 제조
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing Information2-Pyridinemethanethiol: INACTIVE
제조 방법
By hydrolysis of 2-pyridylmethyl-tert-butyl sulfide with sulfuric acid in aqueous solution; from 2-pyridylmethyl chloride
공급사60 곳
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
JINING XINHE CHEMICAL CO., LTD+8615318402391 · [email protected]
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