기본 정보
- 표준 SMILES
COC(C)(C)CCC[C@H](C)C/C=C/C(C)=C/C(=O)OC(C)C- InChIKey
NFGXHKASABOEEW-GYMWBFJFSA-N- 분자식
- C19H34O3
- 평균 분자량
- 310.5 g/mol
- 단동위원소 질량
- 310.25079494
이름 및 식별자
- 우선 이름
- S-Methoprene
- IUPAC
- propan-2-yl (2E,4E,7S)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate
- 현지명
- S-(+)-메토프렌
- 영어명
- S-(+)-Methoprene
- 분자식
- C19H34O3
- 분자량
- 310.47
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
40596-69-8、65733-16-6- PubChem CID
- 1711973
- DTXSID
DTXSID1035783- ChEBI
CHEBI:39255- UNII
- 4YIQ0A94UR
- EC Number
- 613-834-0
- Nikkaji
- J344.494E
물성
구조 계산 물성
- XLogP
- 5.5
- 극성 표면적
- 35.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 378
실험 및 물리화학적 성질
물리화학적 성질
- 끓는 점
- 385.7 · 385.7±25.0 °C(Predicted)
- 밀도
- 0.913 · 0.913±0.06 g/cm3(Predicted)
- 저장 조건
- -20 °C · Store at -20°C
- 용해도
- 20 mg/ml,Ethanol: · DMF: 20 mg/ml,Ethanol: 10 mg/ml
- 물리적 상태
- A neat oil
- 색상
- Colorless to light yellow
- Henry's Law Constant
- 1.5 · 1.5×100 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- 안정성
- 감광성
- InChI
- InChI=1S/C19H34O3/c1-15(2)22-18(20)14-17(4)11-8-10-16(3)12-9-13-19(5,6)21-7/h8,11,14-16H,9-10,12-13H2,1-7H3/b11-8+,17-14+/t16-/m1/s1
- InChIKey
- NFGXHKASABOEEW-GYMWBFJFSA-N
- SMILES
- C(OC(C)C)(=O)/C=C(\C)/C=C/C[C@@H](C)CCCC(OC)(C)C
- EPA
- S-Methoprene (65733-16-6)
안전 및 규제
GHS 분류
GHS Classification
Warning
H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Warning
유해성 정보
Other Safety Information
IMAP assessments - 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, 1-methylethyl ester, (S-(E,E))-: Environment tier I assessment;IMAP assessments - 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, 1-methylethyl ester, (S-(E,E))-: Human health tier I assessment
Hazard Classes and Categories
Skin Irrit. 2 (16.7%);STOT SE 3 (16.7%);Aquatic Acute 1 (100%);Aquatic Chronic 1 (66.7%)
Hazardous to the aquatic environment (acute) - category 1;Hazardous to the aquatic environment (chronic) - category 1
Aquatic Acute 1;Aquatic Chronic 1
규제 정보
안전 데이터
- HS 번호
- 2918999090
- hazard_code
- Xi
- 위험 참고 사항
- Irritant
화학 및 산업
용도 및 제조
응용 분야
개요(S)-(+)-Methoprene is a widely-used insect growth regulator. It is remarkable for its lack of significant effects against a wide variety of mammals, although concerns remain for its effects on arthropod development. Methoprene acts as an activator of the juvenile hormone receptor, known as Methoprene-tolerant or Met (Kd = 12.3 nM). Met is a transcription factor that, upon activation with juvenile hormone or methoprene, regulates gene expression that inhibits metamorphosis.
상·하류 제품 정보
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하류 제품
공급사50 곳
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