StartseiteMCPWorkbenchSkills
StartseiteWorkbenchBenachrichtigungenMein Bereich
Huagongshe Open Project:[email protected]KI-Anbindung: llms.txt · MCP-AnleitungDatenschutz · Nutzungsbedingungen · Supportv1.7.8
  1. Startseite
  2. /Verbindung

1,2-Benzenedicarboxylic acid, diisoheptyl ester

HCID 591200
NotizenReaktionen
GrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

CAS
41451-28-9
Standard-SMILES
CC(C)CCCCOC(=O)c1ccccc1C(=O)OCCCCC(C)C
InChIKey
RKELNIPLHQEBJO-UHFFFAOYSA-N
Summenformel
C22H34O4
Durchschnittliche Molmasse
362,5 g/mol
Monoisotopische Masse
362,24570956

Überblick

Diisoheptyl phthalate has been reported in Lythrum salicaria with data available.

Namen und Bezeichner

Bevorzugter Name
1,2-Benzenedicarboxylic acid, diisoheptyl ester
IUPAC
bis(5-methylhexyl) benzene-1,2-dicarboxylate
Englischer Name
Diisoheptylphthalate
Summenformel
C22H34O4
Molmasse
362.5

Namen und Synonyme

Diisoheptyl phthalate41451-28-9Di-(5-methylhexyl)phthalateD-5-Mhpbis(5-methylhexyl) benzene-1,2-dicarboxylate9JJP9B98FGJAYFLEX 771,2-Benzenedicarboxylic acid, diisoheptyl esterDTXSID70872296RefChem:5878311,2-bis(5-methylhexyl) benzene-1,2-dicarboxylateDTXCID101476720
Weitere Namen anzeigen
Bis(5-methyl-1-hexyl) phthalate in isooctane1,2-Benzenedicarboxylic acid, 1,2-bis(5-methylhexyl) ester
Bis(5-methylhexyl) phthalateDiisoheptylphthalate90937-19-2Phthalic acid, bis-5-methylhexyl esterstarbld0030002DSSTox_CID_9017UNII-9JJP9B98FGDi-Iso- Heptyl- Phthalates

Datenbank-Bezeichner

CAS
41451-28-9、90937-19-2
PubChem CID
591200
DTXSID
DTXSID30872297
ChEMBL
CHEMBL1893293
UNII
9JJP9B98FG
Nikkaji
J1.107.984I

Eigenschaften

Berechnete Struktureigenschaften

XLogP
7,4
Polarare Oberfläche (TPSA)
52,6 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
14
Schwere Atome
26
Formalladung
0
Komplexität
365

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Hazard Traits - Reproductive Toxicity

1,2-Benzenedicarboxylic acid, diisoheptyl ester: Does not have an individual approval but may be used under an appropriate group standard

Toxikologische Informationen

Health Effects · 1 Eintrag

Phthalate esters are endocrine disruptors. Animal studies have shown that they disrupt reproductive development and can cause a number of malformations in affected young, such as reduced anogenital distance (AGD), cryptorchidism, hypospadias, and reduced fertility. The combination of effects associated with phthalates is called 'phthalate syndrome’. (A2883)

Exposure RoutesOral (L1903) ; inhalation (L1903) ; dermal (L1903)
Toxicity Summary · 1 Eintrag

Phthalate esters are endocrine disruptors. They decrease foetal testis testosterone production and reduce the expression of steroidogenic genes by decreasing mRNA expression. Some phthalates have also been shown to reduce the expression of insulin-like peptide 3 (insl3), an important hormone secreted by the Leydig cell necessary for development of the gubernacular ligament. Animal studies have shown that these effects disrupt reproductive development and can cause a number of malformations in affected young. (A2883)

Signs and SymptomsPhthalate esters are endocrine disruptors and can cause a number of developmental malformations termed 'phthalate syndrome'. (A2883)
Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

Chemie und Industrie

Pharmakologische Informationen

Metabolism/Metabolites · 1 Eintrag

Phthalate esters are first hydrolyzed to their monoester derivative. Once formed, the monoester derivative can be further hydrolyzed in vivo to phthalic acid or conjugated to glucuronide, both of which can then be excreted. The terminal or next-to-last carbon atom in the monoester can also be oxidized to an alcohol, which can be excreted as is or first oxidized to an aldehyde, ketone, or carboxylic acid. The monoester and oxidative metabolites are excreted in the urine and faeces. (A2884)

Verwendung und Herstellung

Uses · 1 Eintrag

Phthalate esters are mainly used as plasticizers, primarily used to soften polyvinyl chloride. They are found in a number of products, including glues, building materials, personal care products, detergents and surfactants, packaging, children's toys, paints, pharmaceuticals, food products, and textiles. Phthalates are used in a variety of household applications such as shower curtains, vinyl upholstery, adhesives, floor tiles, food containers and wrappers, and cleaning materials. Personal care items containing phthalates include perfume, eye shadow, moisturizer, nail polish, liquid soap, and hair spray. (L1903)

Household ProductsInformation on 1 consumer products that contain Diisoheptyl phthalate in the following categories is provided:

Anbieter42 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
盐城通铭生物科技有限公司15195160625 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]

Zugehörige Reaktionen

0
Reaktionsaufzeichnung erstellen

Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.

Notizen zur Verbindung

Wird geladen…

Auf dieser SeiteGrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
Syntechem Co.,Ltd[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]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海艾梯西生物科技有限公司18721763493 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
河北贞佳新材料有限公司0319-5925599 13315915972 · [email protected]
上海思域化工科技有限公司021-34053660 · [email protected]
山东小野化学股份有限公司0539-6362799 20)
金锦乐(湖南)化学有限公司18001959627(微信同号) 18001959627 · [email protected]
常州阿桑奇科技有限公司18961267976 · [email protected]
上海泰坦科技股份有限公司13023226327 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
南京昊绿生物科技有限公司025-84622273 17361806303 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
上海安谱实验科技股份有限公司18502138905 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
北京索莱宝科技有限公司17801761073 18101056239 · [email protected]