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trans-2,3,4-Trimethoxycinnamic acid

HCID 735841
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
33130-03-9
Standard SMILES
COc1ccc(/C=C/C(=O)O)c(OC)c1OC
InChIKey
ZYOPDNLIHHFGEC-FNORWQNLSA-N
Molecular formula
C12H14O5
Average molar mass
238.24 g/mol

Overview

Trans-2, 3, 4-Trimethoxycinnamate is a hydroxycinnamic acid.

Names & identifiers

Preferred name
trans-2,3,4-Trimethoxycinnamic acid
IUPAC
(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid

Names & synonyms

trans-2,3,4-Trimethoxycinnamic acidEINECS 251-388-5RefChem:898724251-388-533130-03-92,3,4-Trimethoxycinnamic acid116406-19-03-(2,3,4-Trimethoxyphenyl)acrylic Acid(2E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoic acidtrans-3-(2,3,4-Trimethoxyphenyl)-2-propenoic acidMFCD00014376(E)-3-(2,3,4-trimethoxyphenyl)acrylic acid
Show more names
(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid2-Propenoic acid, 3-(2,3,4-trimethoxyphenyl)-trans-2,3,4-TrimethoxycinnamicTrans-2, 3, 4-TrimethoxycinnamateSTK698033AKOS0001453213-(2,3,4-trimethoxyphenyl)propenoic Acid2-propenoic acid, 3-(2,3,4-trimethoxyphenyl)-, (2E)-

Database identifiers

CAS
33130-03-9
PubChem CID
735841
ChEBI
CHEBI:166597
EC Number
251-388-5
Nikkaji
J308.293H、J319.502C

Properties

Computed structural propertiesFilling in

XLogP
1.7
Topological polar surface area
65 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
17
Formal charge
0
Complexity
276

Experimental & physicochemical properties

Physical DescriptionSolid

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

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 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Chemistry & industry

Pharmacology

Tissue LocationsProstate

Suppliers96 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
湖北微斯汀科技有限公司027-61182895 13367240285 · [email protected]
Aceschem Inc.+1-817863-6948 +1-(817)863-6948 · [email protected]
苏州启航生物科技有限公司18662190603;18151111370 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
ZHEJIANG JIUZHOU CHEM CO., LTD+86-0576225566889 +86-13454675544 · [email protected];[email protected];[email protected]
湖北远成药业有限公司18062666904 · [email protected]
TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
苏州亚科科技股份有限公司0512-87182055 13451648594 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
武汉天植生物技术有限公司18607101326 15172504745 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
常州安奈凯医药科技有限公司+86-0519-8359-8696 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
上海珈得尔化学技术有限公司021-4007787-550 400-7787-550 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
郑州阿尔法化工有限公司0371-53765687 18937137882 · [email protected]
南京择优新材料科技有限公司173-40521416 17340521416 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]

Related reactions

1 records
New reaction record
HRID 383589 reaction equation
HRID 383589As reactantuspto-grants-2013_02

Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes