(R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid

HCID 2316094CAS 76769-07-8
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CC(C)[C@@H](Nc1ccc(C(F)(F)F)cc1Cl)C(=O)O
InChIKey
YKSHSSFDOHACTC-SNVBAGLBSA-N
분자식
C12H13ClF3NO2
평균 분자량
295.68 g/mol
단동위원소 질량
295.058691

이름 및 식별자

우선 이름
(R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid
IUPAC
(2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoic acid
영어명
(2S)-2-[[2-chloro-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanoate
분자식
C12H13ClF3NO2
분자량
295.69

이름 및 동의어

76769-07-8(R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acidN-[2-Chloro-4-(trifluoromethyl)phenyl]-D-valine(2-chloro-4-(trifluoromethyl)phenyl)-D-valine(2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoic acid(R)-2-[[2-Chloro-4-(trifluoromethyl)phenyl]amino]-3-methylbutanoic Acid(2R)-2-{[2-CHLORO-4-(TRIFLUOROMETHYL)PHENYL]AMINO}-3-METHYLBUTANOIC ACIDMFCD22421624tau-fluvalinate TP1SCHEMBL5598915SCHEMBL31070905DTXSID70998081
이름 더 보기
Fluvalinate Impurity 2D-Valine,N-[2-chloro-4-(trifluoroMethyl)phenyl]-(R)-2-[2-Chloro-4-(trifluoromethyl)anilino]-3-methylbutyric acid2-[2-chloro-4-α，α，α-trifluoromethyl anilino-3-methyl butyric acid2-[[2-Chloro-4-(trifluoromethyl)phenyl]amino]-3-methylbutanoic acid(2S)-2-[[2-chloro-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanoate
MFCD09863466(R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoicacidAKOS015998970FC90388SY282361NS00115846N-[2-chloro-4-(trifluoromethyl) phenyl]-d-valine2-chloro-4-(trifluromethyl) anilino-3 methyl butanoic acid

데이터베이스 식별자

CAS
76769-07-8
PubChem CID
2316094
DTXSID
DTXSID70998081
Nikkaji
J153.975B

물성

구조 계산 물성

XLogP
4.4
극성 표면적
49.3 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
19

물리화학적 성질

녹는점
63 · 63-65°C
끓는 점
381.545 · 381.545±42.00 °C(Press: 760.00 Torr)(predicted)
밀도
1.37 · 1.370±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
저장 조건
2 · 2-8°C
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태
고체

화학 및 산업

응용 분야 · 1건

용도N-[2-Chloro-4-(trifluoromethyl)phenyl]-D-valine is an intermediate in synthesizing τ-Fluvalinate (F601100), a synthetic pyrethroid aracacide. τ-Fluvalinate is commonly used to control Varroa jacobsoni (a parasitic mite) in honey bee colonies.

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공급사8 곳

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
苏州岚云医药科技有限公司2332782371 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
湖北万业众诚化学试剂有限责任公司18671296875 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]

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