2-[(2-클로로-6-플루오로벤질)티오]에틸아민

2-(2-Chloro-6-fluorobenzylthio)ethylamine

HCID 2736553
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기본 정보

CAS
175136-76-2
표준 SMILES
NCCSCc1c(F)cccc1Cl
InChIKey
KNNHPOGBBNRNDH-UHFFFAOYSA-N
분자식
C9H11ClFNS
평균 분자량
219.71 g/mol
단동위원소 질량
219.0284764

이름 및 식별자

우선 이름
2-(2-Chloro-6-fluorobenzylthio)ethylamine
IUPAC
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethanamine
현지명
2-[(2-클로로-6-플루오로벤질)티오]에틸아민
영어명
2-[(2-Chloro-6-fluorobenzyl)thio]ethylamine
분자식
C9H11ClFNS
분자량
219.71

이름 및 동의어

2-(2-Chloro-6-fluorobenzylthio)ethylamine175136-76-22-[(2-chloro-6-fluorobenzyl)thio]ethylamineMFCD000526832-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethanamine2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethanamine2-[(2-chloro-6-fluorobenzyl)thio]ethanamine2-((2-Chloro-6-fluorobenzyl)thio)ethan-1-amine2-[(2-chloro-6-fluorophenyl)methylthio]ethanamine2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}ethan-1-amine2-([(2-chloro-6-fluorophenyl)methyl]sulfanyl)ethan-1-amine2-Aminoethyl 2-chloro-6-fluorobenzyl sulphide
이름 더 보기
2-[(2-클로로-6-플루오로벤질)티오]에틸아민BUTTPARK 29\08-96Aminoethyl (2-chloro-6-fluorobenzyl) sulfide2-(2-Chloro-6-fluorobenzylthio)ethylamine97%Aminoethyl (2-chloro-6-fluorobenzyl) sulphide2-(2-Chloro-6-fluorobenzylthio)ethylamine 97%2-Aminoethyl2-chloro-6-fluorobenzylsulphide97%
SCHEMBL2109104SCHEMBL7557343DTXSID90371438KNNHPOGBBNRNDH-UHFFFAOYSA-NALBB-027076SBB095859STK826090AKOS000430471

데이터베이스 식별자

CAS
175136-76-2
PubChem CID
2736553
DTXSID
DTXSID90371438
EC Number
670-857-9

물성

구조 계산 물성

XLogP
2.2
극성 표면적
51.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
4
무거운 원자 수
13

물리화학적 성질

끓는 점
140 °C · 140 °C
밀도
1.273 · 1.273±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
산도 계수 (pKa)
8.85 · 8.85±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Corr. 1B (100%)；Acute Tox. 4 (100%)

안전 데이터

ridadr
2735
HS 번호
2930909899
risk_code
34
hazard_code
C
safety_code
26-36/37/39-45
위험 등급
CORROSIVE

화학 및 산업

공급사18 곳

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]

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