Basic information
- CAS
3610-35-3- Standard SMILES
COc1cccc2[nH]cc(CCN)c12- InChIKey
WMBARRJMPVVQEZ-UHFFFAOYSA-N- Molecular formula
- C11H14N2O
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.11061307
Names & identifiers
- Preferred name
- 1H-Indole-3-ethanamine, 4-methoxy-
- IUPAC
- 2-(4-methoxy-1H-indol-3-yl)ethanamine
- English name
- 4-Methoxytryptamine
- Molecular formula
- C11H14N2O
- Molecular weight
- 190.24
Names & synonyms
3610-35-31H-Indole-3-ethanamine, 4-methoxy-2-(4-methoxy-1H-indol-3-yl)ethan-1-amine4-Methoxy-1H-indole-3-ethanamineDTXSID70189679RefChem:438731DTXCID80112170835-755-24-Methoxytryptamine2-(4-methoxy-1H-indol-3-yl)ethanamineMFCD03848075CHEMBL343529
Show more names
3-(2-Aminoethyl)-4-methoxyindole4-Methoxy-1H-indole-3-ethaneamine3-(2-Aminoethyl)-4-methoxy-1H-indole2-(4-methoxy-1H-indol-3-yl)ethylamine
SCHEMBL1460696SCHEMBL29728139WMBARRJMPVVQEZ-UHFFFAOYSA-NDAA61035BDBM50025223AKOS006278394EBC-182244AS-41707
Database identifiers
- CAS
3610-35-3- PubChem CID
- 19219
- DTXSID
DTXSID70189679- ChEMBL
CHEMBL343529- EC Number
- 835-755-2
- Nikkaji
- J13.692A
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Melting point
- 139 · 139-140℃
- Boiling point
- 380 · 380.0±27.0 °C(Predicted)
- Density
- 1.171 · 1.171
- pka
- 17.43 · 17.43±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H302-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H302-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers9 total
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Shanxi Tihondan Pharmaceutical Technology Co., Ltd+8618235132063 · [email protected]
苏州键合化学试剂有限公司0512-69561983 13914027025 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
苏州美诺医药科技有限公司0512-69561983 13914027025 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
3 records
Compound notes
Loading…