Basic information
- CAS
1010-95-3- Standard SMILES
Cc1ccc2[nH]cc(CCN)c2c1.Cl- InChIKey
RBHDFGBPJGEYCK-UHFFFAOYSA-N- Molecular formula
- C11H15ClN2
- Average molar mass
- 210.7 g/mol
- Monoisotopic mass
- 210.0923762
Names & identifiers
- Preferred name
- 5-Methyltryptamine hydrochloride
- IUPAC
- 2-(5-methyl-1H-indol-3-yl)ethanamine;hydrochloride
- English name
- 5-Methyltryptamine hydrochloride
- Molecular formula
- C11H15ClN2
- Molecular weight
- 210.7
Names & synonyms
5-Methyltryptamine hydrochlorideRefChem:53690826346-40-71010-95-32-(5-methyl-1H-indol-3-yl)ethanamine hydrochloride55795-89-6MFCD000126833-(2-Aminoethyl)-5-methylindole hydrochloride2-(5-methyl-1H-indol-3-yl)ethan-1-amine hydrochloride1H-Indole-2-ethanamine,5-methyl-, hydrochloride (1:1)1H-Indole-3-ethanamine, 5-methyl-, hydrochloride (1:1)5-Methyl-1H-indole-3-ethylamine monohydrochloride
Show more names
TIMTEC-BB SBB0034405-Methyltryptamine hydrochl5-METHYLTRYPTAMNE HCL 98.0%MIN5-methy tryptamine hydrochloride5-Methyl-1H-indol-3-ethanamine HCl3-(2-AMINOETHYL)-5-METHYLINDOLE HCL5-Methyltryptamine hydrochloride (ab120591)5-Methyl-1H-Indole-3-ethanaMine Hydrochloride
2-(5-methyl-1H-indol-3-yl)ethanamine;hydrochloridehydron;2-(5-methyl-1H-indol-3-yl)ethanamine;chloride5-Methyltryptamine HCl2-(5-methylindol-3-yl)ethylamine, chloride[2-(5-methyl-1H-indol-3-yl)ethyl]amine hydrochloride5-Methyl-1H-Indole-3-ethanamine Hydrochloride; 3-(2-Aminoethyl)-5-methylindole Hydrochloride;EINECS 213-777-82-(5-Methyl-1H-indol-3-yl)ethylamine hydrochloride
Database identifiers
- CAS
1010-95-3- PubChem CID
- 6917145
- DTXSID
DTXSID40143627- ChEBI
CHEBI:229634- EC Number
- 213-777-8
Properties
Computed structural properties
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Melting point
- 290 · 290-292 °C
- solubility
- DMSO (Slightly), Methanol (Slightly), Water (Slightly)
- form
- Solid
- color
- Pale Beige to Light Tan
- Water Solubility
- 2 O: · H2O: soluble 50mg/mL, clear, yellow
- Sensitive
- Hygroscopic
- InChI
- 1S/C11H14N2.ClH/c1-8-2-3-11-10(6-8)9(4-5-12)7-13-11;/h2-3,6-7,13H,4-5,12H2,1H3;1H
- InChIKey
- RBHDFGBPJGEYCK-UHFFFAOYSA-N
- SMILES
- Cl.Cc1ccc2[nH]cc(CCN)c2c1
- CAS DataBase Reference
- 1010 · 1010-95-3
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Hazard Codes
- T+
- Risk Statements
- 26 · 26/27/28
- Safety Statements
- 22 · 22-24/25
- RIDADR
- 2811 · 2811
- WGK Germany
- 3 · 3
- F
- 10 · 10
- HazardClass
- 6.1 · 6.1
- PackingGroup
- Ⅲ
- Storage Class
- 11 · 11 - Combustible Solids
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
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Warning
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.；There is 1 notification provided by 1 of 2 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (50%)；Eye Irrit. 2A (50%)；STOT SE 3 (50%)
Safety data
- F
- 10
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- ridadr
- 2811
- risk_code
- 26/27/28
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- T+
- safety_code
- 22-24/25
- hazard_class
- 6.1
- Storage Class
- 11 - Combustible Solids
- packing_group
- Ⅲ
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Applications
Usesreactant in synthesis of kinesin spindle protein (KSP) inhibitorsreactant in intramolecular furan Diels-Alder reactionsreactant in Pictet-Spengler-like reactions
Uses5-Methyltryptamine hydrochloride is a methylated derivative of tryptamine, it is a weak antagonist of 5-Hydroxytryptamine (H974990) with weak potency as stimulants of the cardiac sympathetic nerves. 5-Methyltryptamine hydrochloride is also used in the preparation of inhibitors of kinesin spindle protein (KSP), a promising class of anticancer agents.
Suppliers99 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
湖北金梭生物科技有限公司00123456789 · [email protected]
武汉科美沃化工有限公司+86-2785736489 +8618171418573 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
湖北恒硕化工有限公司027-82830253 13995541600 · [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]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
西安泽邦生物科技有限公司[email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
常州市华阳科技有限公司+8615250961469 · [email protected]
武汉贝乐叶生物医药科技有限公司15871353653 18086118076 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
Abblis Chemicals LLC+1-832-373-8299 · [email protected]
上海健超生物科技有限公司15021035486 18081542813 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
武汉科美沃化工有限公司027-85736489 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
上海先诺生物科技有限公司021-50718719 13918719472
上海贤鼎生物科技有限公司4009209199 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
北京汤普森生物科技有限公司+86-13439059536 +86-15201677815 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
武汉美安生物医药科技有限公司15377551262 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
武汉贝乐叶生物医药科技有限公司18086118078 · [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]
Accela ChemBio Inc.+1(858) 699-3322 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
XIAMEN EQUATION CHEMICAL CO.,LTD+86-5926515854 +86-18060954864 · [email protected]
上海博熠生物医药科技有限公司021-021-54331997 18321536537 · [email protected]
湖北恒绿源科技有限公司027-88188016 18717196322 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
成都润泽本土化工有限公司028-88469284 18000562381 · [email protected]
上海岚克医药科技发展有限公司0086-21-58956006
南通市苏北化工原料有限公司0513-85290972 18762756250 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
Related reactions
13 records
Compound notes
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