기본 정보
- CAS
745052-98-6- 표준 SMILES
O=C(O)/C(=C/C1CCOCC1)c1ccc(S(=O)(=O)C2CC2)cc1- InChIKey
MNNGVQPWHYBWLL-LFIBNONCSA-N- 분자식
- C17H20O5S
- 평균 분자량
- 336.4 g/mol
- 단동위원소 질량
- 336.10314491
이름 및 식별자
- 우선 이름
- (E)-2-(4-(cyclopropylsulfonyl)phenyl)-3-(tetrahydro-2H-pyran-4-yl)acrylic acid
- IUPAC
- (E)-2-(4-cyclopropylsulfonylphenyl)-3-(oxan-4-yl)prop-2-enoic acid
- 영어명
- (E)-2-(4-(cyclopropylsulfonyl)phenyl)-3-(tetrahydro-2H-pyran-4-yl)acrylic acid
- 분자식
- C17H20O5S
- 분자량
- 336.4
이름 및 동의어
745052-98-6(E)-2-(4-(cyclopropylsulfonyl)phenyl)-3-(tetrahydro-2H-pyran-4-yl)acrylic acid(E)-2-(4-cyclopropylsulfonylphenyl)-3-(oxan-4-yl)prop-2-enoic acid(2E)-2-[4-(Cyclopropanesulfonyl)phenyl]-3-(oxan-4-yl)prop-2-enoic acid(E)-2-[4-(Cyclopropylsulfonyl)phenyl]-3-(tetrahydro-2H-pyran-4-yl)acrylic acidSCHEMBL2652180DTXSID30719279MNNGVQPWHYBWLL-LFIBNONCSA-N(E)-2-(4-cyclopropanesulfonyl phenyl)-3-(tetrahydropyran-4-yl)acrylic acid(E)-2-(4-cyclopropanesulfonylphenyl)-3-(tetrahydropyran-4-yl)acrylic acid(2E)-2-[4-(Cyclopropylsulfonyl)phenyl]-3-(tetrahydro-2H-pyran-4-yl)propan-2-enoic acid(E)-2-(4-(cyclopropylsulfonyl)phenyl)-3-(tetrahydro-2H-pyran-4-yl)acrylicacid
이름 더 보기
2-(4-(cyclopropylsulfonyl)phenyl)-3-(tetrahydro-2H-pyran-4-yl)acrylic acid(E)-2-[4-(Cyclopropylsulfonyl)phenyl]-3-(tetrahydropyran-4-yl)-2-propenoic acid(2E)-2-[4-(Cyclopropylsulfonyl)phenyl]-3-(tetrahydro-2H-pyran-4-yl)prop-2-enoic acidBenzeneacetic acid, 4-(cyclopropylsulfonyl)-α-[(tetrahydro-2H-pyran-4-yl)methylene]-, (αE)-
데이터베이스 식별자
- CAS
745052-98-6- PubChem CID
- 56971691
- DTXSID
DTXSID30719279
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 89.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 556
물리화학적 성질
- 녹는점
- 93 · 93-95℃
- 끓는 점
- 589 · 589.0±50.0 °C(Predicted)
- 밀도
- 1.394 · 1.394
- 산도 계수 (pKa)
- 3.41 · 3.41±0.19(Predicted)
화학 및 산업
상·하류 제품 정보
상류 원료
하류 제품
공급사9 곳
广州科瑞生物技术有限公司20-66003216 18666003216 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
上海智乾生物科技有限公司[email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
관련 반응
3건
화합물 노트
불러오는 중…