2-Amino-3,6-dimethoxybenzaldehyde
Basic information
- CAS
126522-16-5- Standard SMILES
COc1ccc(OC)c(C=O)c1N- InChIKey
QKEMEAAMUKZVAR-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- 2-Amino-3,6-dimethoxybenzaldehyde
- IUPAC
- 2-amino-3,6-dimethoxybenzaldehyde
- English name
- 2-AMINO-3,6-DIMETHOXYBENZENECARBALDEHYDE
- Molecular formula
- C9H11NO3
- Molecular weight
- 181.19
Names & synonyms
2-amino-3,6-dimethoxybenzaldehyde126522-16-5DTXSID70363371RefChem:255319DTXCID603144182-Amino-3,6-dimethoxybenzenecarbaldehydeMFCD03848397Benzaldehyde, 2-amino-3,6-dimethoxy-SCHEMBL189798882-amino-3,6-dimethoxy-benzaldehydeSBB089790AKOS005069307
Show more names
2-Amino-3,6-dimethoxybenzaldehyde95%2-AMINO-3,6-DIMETHOXYBENZENECARBOXALDEHYDE3,6-Dimethoxyanthranilaldehyde, 3,6-Dimethoxy-2-formylaniline
CS-025526610W-0837
Database identifiers
- CAS
126522-16-5- PubChem CID
- 1487771
- DTXSID
DTXSID70363371- Nikkaji
- J532.505F
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Melting point
- 66 · 66-68°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2922500090 · 2922500090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2922500090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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