기본 정보
- CAS
68186-71-0- 표준 SMILES
CCCCOC(=O)/C=C\C(=O)O- InChIKey
UTOVMEACOLCUCK-PLNGDYQASA-N- 분자식
- C8H12O4
- 평균 분자량
- 172.18 g/mol
- 단동위원소 질량
- 172.07355886
개요
Butyl maleate is a maleate ester.
이름 및 식별자
- 우선 이름
- Monobutyl maleate
- IUPAC
- (Z)-4-butoxy-4-oxobut-2-enoic acid
- 현지명
- 모노 아이소뷰틸 말레산염
- 영어명
- Monobutyl maleate
- 분자식
- C8H12O4
- 분자량
- 172.18
이름 및 동의어
Monobutyl maleate925-21-3Butyl hydrogen maleate2-Butenedioic acid (Z)-, monobutyl ester2-Butenedioic acid (2Z)-, monobutyl estern-butyl maleateF2LD7FVO1L2-Butenedioic acid (2Z)-, 1-butyl esterDTXSID2027337RefChem:7810DTXCID007337213-116-3
이름 더 보기
모노아이소뷰틸말레산염모노아이소뷰틸말레산염(MONOISOBUTYLMALEATE)모노부틸말레에이트monobutylesterBUTYL MALEATE MONOMONO-N-BUTYL MALEATEMALEIC ACID MONOBUTYL ESTER
(Z)-4-butoxy-4-oxobut-2-enoic acidMaleic acid, monobutyl estermono-Butyl maleateMFCD00040407UNII-F2LD7FVO1LMALEIC ACID 1-BUTYL ESTEREINECS 213-116-3Hydrogen butyl maleate
데이터베이스 식별자
- CAS
68186-71-0、925-21-3- PubChem CID
- 5356726
- DTXSID
DTXSID2027337- ChEBI
CHEBI:145719- UNII
- F2LD7FVO1L
- EC Number
- 213-116-3
- Nikkaji
- J102.416G
물성
구조 계산 물성
- XLogP
- 1.1
- 극성 표면적
- 63.6 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 183
실험 및 물리화학적 성질
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
물리화학적 성질
- 녹는점
- -1.5 °C · -1.5°C
- 끓는 점
- 201 °C · 201°C
- 밀도
- 1.099 · 1.099
- 증기압
- 0.2 Pa · 0.2Pa at 25℃
- 굴절률
- 1.458 · 1.458
- 인화점
- 110 °C · >110°C
- 저장 조건
- Refrigerator
- 수용성
- 37 g/L · 37g/L at 20℃
- InChI
- InChI=1S/C8H12O4/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H,9,10)/b5-4-
- InChIKey
- UTOVMEACOLCUCK-PLNGDYQASA-N
- SMILES
- C(OCCCC)(=O)/C=C\C(O)=O
- LogP
- 1.39 at · 1.39 at 30℃
- NIST
- 2 · 2-Butenedioic acid (z)-, monobutyl ester(925-21-3)
- EPA
- 2 · 2-Butenedioic acid (2Z)-, monobutyl ester (925-21-3)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 31.1% (73 of 235) of reports.
Danger
H314 (52.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P332+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 235 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
유해성 정보
Regulatory Information
Chemical: 2-Butenedioic acid, (Z)-, monobutyl ester
Status: Active Update: 28-10-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/10749
2-Butenedioic acid (2Z)-, monobutyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationEvaluation - Maleic acid esters (short chain)
Hazard Classes and Categories
Skin Corr. 1B (52.3%)
Skin corrosion/irritation - Category 1
안전 데이터
- tsca
- TSCA listed
- 기존화학 물질
- KE-03979
화학 및 산업
용도 및 제조
General Manufacturing Information2-Butenedioic acid (2Z)-, 1-butyl ester: ACTIVE
공급사35 곳
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
湖北威德利化学试剂有限公司186-02735115 18062128043 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广东百科试剂有限公司13532366769 13686183698 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
金锦乐(湖南)化学有限公司18001959627(微信同号) 18001959627 · [email protected]
贝弗斯曼（武汉）生物科技有限公司0711-5919292 15307133740 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
湖北康鑫源顺医药化工有限公司027-51831887 15337167856 · [email protected]
湖北达豪化工有限公司027-59106191 13986034860 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
湖北麦凯斯精化科技有限责任公司13026126800 13026126800;13027176014 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
武汉卡米克科技有限公司18162538168 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
上海珅桔化工有限公司13167128868 13661427209 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
郓城恒立生物科技有限公司15552097599 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
湖北实顺生物科技有限公司027-59223025 15107168801 · [email protected]
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