Basic information
- CAS
2400-36-4- Standard SMILES
COc1ccc2c(C)c[nH]c2c1- InChIKey
LSMGVUHULSBVAW-UHFFFAOYSA-N- Molecular formula
- C10H11NO
- Average molar mass
- 161.2 g/mol
- Monoisotopic mass
- 161.08406397
Names & identifiers
- Preferred name
- 6-methoxy-3-methyl-1H-indole
- IUPAC
- 6-methoxy-3-methyl-1H-indole
- English name
- 6-methoxy-3-methyl-1H-indole
- Molecular formula
- C10H11NO
- Molecular weight
- 161.2
Names & synonyms
6-methoxy-3-methyl-1H-indole2400-36-4DTXSID30315977RefChem:543640DTXCID90267100855-538-66-methoxy-3-methylindoleMFCD131786611H-Indole,6-methoxy-3-methyl-NSC2983333-methyl-6-methoxyindole6-methoxy-3-methylin-dole
Show more names
1H-INDOLE, 6-METHOXY-3-METHYL-
SCHEMBL1120777SCHEMBL3548958LSMGVUHULSBVAW-UHFFFAOYSA-LSMGVUHULSBVAW-UHFFFAOYSA-NCAA40036AKOS022794314NSC-298333AS-59535
Database identifiers
- CAS
2400-36-4- PubChem CID
- 326653
- DTXSID
DTXSID30315977- EC Number
- 855-538-6
- Nikkaji
- J909.467I
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 25 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
- H302-H315-H319-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers9 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
苏州奥佰医药科技有限公司1483287082 19962651230 · [email protected]
上海智存生物科技有限公司 (上海图芃生物科技有限公司）13761914825 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海亿万化工有限公司00-18662433356 18662433356 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
7 records
Compound notes
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