Heptanoyl chloride (HCID 17313)

이름 및 식별자

우선 이름: Heptanoyl chloride
IUPAC: heptanoyl chloride
현지명: 헵타노일 클로라이드
영어명: Heptanoyl chloride
분자식: C7H13ClO
분자량: 148.63

이름 및 동의어

HEPTANOYL CHLORIDE2528-61-2Enanthyl chlorideheptanoylchloriden-Heptanoyl chlorideEnanthic chlorideEnanthoyl chlorideheptanoic acid chlorideMFCD00000763Z2P33BJ4B5Oenanthic chlorideenanthylchloride

이름 더 보기

에난틴클로라이드에난틸클로라이드염화헵타노일헵타노일클로라이드염화헵타노일(HEPTANOYLCHLORIDE)헵타노일 클로라이드HeptanoyLheptanoylchloridn-hetanoyl chlorideHEPTANOYL-2-CHLORIDE

Enanthoyl Chloride; Enanthyl Chloride; Heptanoic Acid Chloride; n-Heptanoyl ChlorideEINECS 219-775-3C6H13COClHeptanoyl chloride, 99%EC 219-775-3UNII-Z2P33BJ4B5SCHEMBL825395DTXSID8062496

데이터베이스 식별자

CAS: 2528-61-2
PubChem CID: 17313
DTXSID: DTXSID8062496
UNII: Z2P33BJ4B5
EC Number: 219-775-3
Nikkaji: J95.639B

물성

구조 계산 물성

XLogP: 3.5
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 5
무거운 원자 수: 9
형식 전하: 0
복잡도: 81

실험 및 물리화학적 성질

Chemical ClassesToxic Gases & Vapors -> Acid Halides

SpringerMaterials PropertiesBoiling point

Physical DescriptionColorless to light yellow liquid with a pungent odor; [Acros Organics MSDS]

물리화학적 성질

녹는점: -84 °C · -84 °C
끓는 점: 173 °C · 173 °C (lit.)
밀도: 0.96 g/mL · 0.96 g/mL at 25 °C (lit.)
증기압: 1.18 hPa · 1.18hPa at 20℃
굴절률: 20 · n20/D 1.43(lit.)
인화점: 137 °F · 137 °F
저장 조건: Inert atmosphere,Room Temperature
용해도: 클로로포름에 용해됨
물리적 상태: 액체
색상: 무색투명~연황색
수용성: 물과 반응
BRN: 605636 · 605636
안정성: 수분에 민감한
InChI: 1S/C7H13ClO/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3
InChIKey: UCVODTZQZHMTPN-UHFFFAOYSA-N
SMILES: CCCCCCC(Cl)=O
NIST: Heptanoyl chloride(2528-61-2)
EPA: Heptanoyl chloride (2528-61-2)

화학적 성질

Clear colorless to light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H290 (68.4%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P260, P264, P264+P265, P271, P280, P284, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 158 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 27-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13180

Hazards SummaryReacts with water evolving toxic gas; Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; A lachrymator; Harmful by ingestion, inhalation, and skin absorption; [Acros Organics MSDS]

Hazard Classes and CategoriesMet. Corr. 1 (68.4%)

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk: 1
tsca: TSCA listed
ridadr: UN 2920 8/PG 2
HS 번호: 29159000
risk_code: 26-34-37
hazard_code: T+,C
safety_code: 26-36/37/39-38-45-25
포장분류: II
위험 등급: 8
기존화학 물질: KE-18305
F 고인화성물질: 9-21
Hazard Classifications: Acute Tox. 1 InhalationAquatic Chronic 3Eye Dam. 1Skin Corr. 1B
스토리지 클래스: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationHeptanoyl chloride: ACTIVE

응용 분야

용도Heptanoyl Chloride is used in the synthesis of novel class of 2-Aminopyrimidines as CDK1 and CDK2 inhibitors.

일반 설명Heptanoyl chloride reacts with 2-ethylthiophene in the presence of stannic chloride to give 2-ethyl-5-heptanoylthiophene.

상·하류 제품 정보

상류 원료

카프릴릴글라이콜 헵틸릭 산

하류 제품

HEPTANOIC ANHYDRIDE 2-(N-Heptanoyl)thiophene 7-Tridecanol Methyl 3-oxoheptanoate 1-(3,4-dimethoxyphenyl)heptan-1-one Benzoic acid, 2-hexyl-4,6-dihydroxy-, methyl ester 알릴 헵타노에이트

공급사50 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]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

연결된 노트

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헵타노일 클로라이드

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