3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde
Properties
- Molecular formula
- C7H9NO
- Molar mass
- 123.15 g/mol
- Exact mass
- 123.0684 Da
- logP
- 1.44Crippen estimate
- Polar surface area
- 32.9 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
2199-58-8SMILES
CC1=CC(=C(N1)C=O)CInChIKey
RDFZYUOHJBXMJA-UHFFFAOYSA-NInChI
InChI=1S/C7H9NO/c1-5-3-6(2)8-7(5)4-9/h3-4,8H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde
Work with 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde
Similar compounds
3,5-Dimethylpyrrole-2-carboxylic acid4513-93-340 % similar
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2,4,6-Trimethylbenzaldehyde487-68-339 % similar
2,6-Dimethyl-4-pyridinol13603-44-638 % similar
3-(Aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-one771579-27-238 % similar
Semaxinib204005-46-938 % similar
3,4-Dimethylbenzaldehyde5973-71-738 % similar
3,5-Dimethyl-4-hydroxybenzaldehyde2233-18-336 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.