Basic information
- CAS
28290-41-7- Standard SMILES
CC(C)=CCCC(C)=CCCC(C)=CCBr- InChIKey
FOFMBFMTJFSEEY-UHFFFAOYSA-N- Molecular formula
- C15H25Br
- Average molar mass
- 285.26 g/mol
- Monoisotopic mass
- 284.1139629
Names & identifiers
- Preferred name
- Farnesyl bromide
- IUPAC
- 1-bromo-3,7,11-trimethyldodeca-2,6,10-triene
- English name
- TRANS,TRANS-FARNESYL BROMIDE
- Molecular formula
- C15H25Br
- Molecular weight
- 285.26
Names & synonyms
Farnesyl bromideDTXSID60338614RefChem:345400DTXCID6028969728290-41-7FOFMBFMTJFSEEY-YFVJMOTDSA-N1-bromo-3,7,11-trimethyldodeca-2,6,10-trieneC15H25BrSCHEMBL442001FOFMBFMTJFSEEY-UHFFFAOYSA-NDB-2548291-bromo-3,7,11-trimethyl-dodeca-2,6,10-triene
Show more names
(2E,6E)-1-bromo-3,7,11-trimethyldodeca-2,6,10-triene(2E,6E)-(E,E)-Farnesyl BromideTRANS,TRANS-FARNESYL BROMIDEtrans,trans-Farnesyl bromide 95%trans,trans-Farnesyl bromide(E,E)-Farnesyl Bromide (~90% purity)1-Bromo-3,7,11-trimethyl-2,6,10-dodecatriene-1-Bromo-3,7,11-trimethyldodeca-2,6,10-triene
Database identifiers
- CAS
28290-41-7- PubChem CID
- 550199
- DTXSID
DTXSID60338614- EC Number
- 628-910-9
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 265
Physicochemical properties
- Boiling point
- 100 · 100-110 °C15 mm Hg(lit.)
- Density
- 1.052 g/mL · 1.052 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.509(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- 2 · 2-8°C
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Oil
- color
- Colourless to Light Brown
- InChI
- InChI=1S/C15H25Br/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11H,5-6,8,10,12H2,1-4H3/b14-9+,15-11+
- InChIKey
- FOFMBFMTJFSEEY-YFVJMOTDSA-N
- SMILES
- C(Br)/C=C(\C)/CC/C=C(\C)/CC/C=C(/C)\C
- CAS DataBase Reference
- 28290 · 28290-41-7
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 315 · H315-H318-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 37 · 37/38-41
- Safety Statements
- 26 · 26-39
- RIDADR
- 3334 · UN 3334
- WGK Germany
- 3 · 3
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 1 Skin · Eye Dam. 1Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+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.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 3334
- risk_code
- 37/38-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xi
- safety_code
- 26-39
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H315-H318-H335
- Hazard Classifications
- Eye Dam. 1Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P280-P305+P351+P338
Chemistry & industry
Applications
UsesAn analog of Farnesol, produced in the dimorphic fungus Candida albicans
UsesFarnesyl bromide was used in the preparation of:S-trans, trans-farnesyl-L-cysteine methylester, a post translational modified amino acidumbelliprenin, starting reagent for the synthesis of (±)-farnesiferol A and (±)-farnesiferol Cprenylated peptides
Suppliers36 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
吉林中科研伸科技有限公司0431-80514535 19917294565 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
斯百全化学（上海）有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
重庆卡兰医药有限公司023-62879767 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
金锦乐(湖南)化学有限公司18001959627(微信同号) 18001959627 · [email protected]
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江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
医恩医疗系统研发(上海)有限公司021-58958002 18930822973 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
北京迈瑞达科技有限公司010-82387566 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
上海亿万化工有限公司00-18662433356 18662433356 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
重庆卡兰医药有限公司[email protected]
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Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
42 records
Compound notes
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