ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
한글명:ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
카스 번호161798-03-4
상품명:ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
CBNumberCB11474517
분자식C18H21NO4S
포뮬러 무게347.43
MOL 파일161798-03-4.mol
화학적 성질
녹는점 | 158-160°C |
끓는 점 | 495.9±55.0 °C(Predicted) |
밀도 | 1.183 |
저장 조건 | under inert gas (nitrogen or Argon) at 2-8°C |
용해도 | 클로로포름(약간 용해됨), 메탄올(약간 용해됨, 초음파처리) |
물리적 상태 | 고체 |
물리적 상태 | 단단한 모양 |
산도 계수 (pKa) | 1.39±0.10(Predicted) |
색상 | 옅은 노랑 |
InChI | InChI=1S/C18H21NO4S/c1-5-22-18(21)16-12(4)19-17(24-16)13-6-7-15(14(8-13)9-20)23-10-11(2)3/h6-9,11H,5,10H2,1-4H3 |
InChIKey | AIQMFFCWDAIGNV-UHFFFAOYSA-N |
SMILES | S1C(C(OCC)=O)=C(C)N=C1C1=CC=C(OCC(C)C)C(C=O)=C1 |
CAS 데이터베이스 | 161798-03-4(CAS DataBase Reference) |