Basic information
- CAS
32387-22-7- Standard SMILES
COc1ccc2[nH]c(C)c(C(=O)O)c2c1- InChIKey
ORUFFPUSVXGKCC-UHFFFAOYSA-N- Molecular formula
- C11H11NO3
- Average molar mass
- 205.21 g/mol
- Monoisotopic mass
- 205.07389321
Names & identifiers
- Preferred name
- 5-methoxy-2-methyl-1H-indole-3-carboxylic acid
- IUPAC
- 5-methoxy-2-methyl-1H-indole-3-carboxylic acid
- English name
- 5-Methoxy-2-methyl-1H-indole-3-carboxylic acid
- Molecular formula
- C11H11NO3
- Molecular weight
- 205.20994
Names & synonyms
5-Methoxy-2-methyl-1H-indole-3-carboxylic acid32387-22-7RefChem:536649862-892-5MFCD004588825-Methoxy-2-methylindole-3-carboxylic acid1H-indole-3-carboxylic acid, 5-methoxy-2-methyl-BAS 01507380Oprea1_222954SCHEMBL14341962-Methyl-3-carboxy-5-methoxyindolALBB-035485
Show more names
5-Methoxy-2-methyl-1H-indole-3-Carbocylic acid
HBA38722SBB027592AKOS000301573ST001932SY074905DB-068619CS-0372985EN300-85501
Database identifiers
- CAS
32387-22-7- PubChem CID
- 674292
- EC Number
- 862-892-5
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 256
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-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
- H335-H319-H315-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers9 total
武汉代为医药科技有限公司027-65318838 13646286950 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
上海超岚化工科技中心QQ：65489617 13301690235 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
Hefei Hirisun Pharmatech Co., Ltd+8615056975894 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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