기본 정보
- CAS
16200-50-3- 표준 SMILES
CCOC(=O)c1[nH]c(C)c(CC)c1CC- InChIKey
YXAABSBFWADBRO-UHFFFAOYSA-N- 분자식
- C12H19NO2
- 평균 분자량
- 209.28 g/mol
- 단동위원소 질량
- 209.14157885
이름 및 식별자
- 우선 이름
- 3,4-Diethyl-2-ethoxycarbonyl-5-methylpyrrole
- IUPAC
- ethyl 3,4-diethyl-5-methyl-1H-pyrrole-2-carboxylate
- 현지명
- 3,4-디에틸-2-에톡시카르보닐-5-메틸피롤
- 영어명
- 3,4-Diethyl-2-ethoxycarbonyl-5-methylpyrrole
- 분자식
- C12H19NO2
- 분자량
- 209.28
이름 및 동의어
3,4-Diethyl-2-ethoxycarbonyl-5-methylpyrroleRefChem:486007621-479-816200-50-3Ethyl 3,4-diethyl-5-methyl-1H-pyrrole-2-carboxylatePYR-05031H-Pyrrole-2-carboxylic acid, 3,4-diethyl-5-methyl-, ethyl esterMFCD00075089Ethyl 3,4-diethyl-5-methyl-2-pyrrolecarboxylateethyl 3,4-diethyl-5-methylpyrrole-2-carboxylate3,4-diethyl-5-methyl-1H-pyrrole-2-carboxylic acid ethyl esterorb1705117
이름 더 보기
3,4-디에틸-2-에톡시카르보닐-5-메틸피롤ETHYL 3 4-DIETHYL-5-METHYL-2-PYRROLE- &3,4-Diethyl-2-ethoxycarbonyl-5-methylpyrrole>ETHYL 3,4-DIETHYL-5-METHYL-2-PYRROLECARBOXYLATE3,4-DIETHYL-2-ETHOXYCARBONYL-5-METHYLPYRROLE 96+%3,4-DIETHYL-5-METHYL-2-PYRROLECARBOXYLIC ACID ETHYL ESTER1H-Pyrrole-2-carboxylicacid, 3,4-diethyl-5-methyl-, ethyl ester
SCHEMBL4201730DTXSID20343587STK726991AKOS000511707SB62094AS-46760DA-09642SY052480
데이터베이스 식별자
- CAS
16200-50-3- PubChem CID
- 590710
- DTXSID
DTXSID20343587- EC Number
- 621-479-8
- Nikkaji
- J382.989H
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 42.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 218
물리화학적 성질
- 녹는점
- 76 °C · 76 °C
- 물리적 상태
- powder to crystal
- 색상
- 흰색에서 거의 흰색
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- HS 번호
- 2933.99.8210
화학 및 산업
공급사26 곳
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
BOC Sciences[email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
海蔚化学86-21-51086038 · [email protected]
Hefei Hirisun Pharmatech Co., Ltd+8615056975894 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
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