Methyl 4-formyl-2-methylbenzoate
Properties
- Molecular formula
- C10H10O3
- Molar mass
- 178.19 g/mol
- Exact mass
- 178.0630 Da
- logP
- 1.59Crippen estimate
- Polar surface area
- 43.4 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
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, P501
Identifiers
CAS number
74733-23-6SMILES
CC1=C(C=CC(=C1)C=O)C(=O)OCInChIKey
LHJKZERUIPGPCK-UHFFFAOYSA-NInChI
InChI=1S/C10H10O3/c1-7-5-8(6-11)3-4-9(7)10(12)13-2/h3-6H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Work with Methyl 4-formyl-2-methylbenzoate
Similar compounds
Methyl 4-((hydroxyimino)methyl)-2-methylbenzoate1261169-50-966 % similar
Methyl 5-formylsalicylate41489-76-363 % similar
Methyl 5-formyl-2-methoxybenzoate78515-16-963 % similar
Methyl 4-methoxy-2-methylbenzoate35598-05-159 % similar
Methyl 4-hydroxy-2-methylbenzoate57556-31-759 % similar
Benzoic acid,4-bromo-2-methyl-,methyl ester99548-55-759 % similar
Methyl 4-formylbenzoate1571-08-057 % similar
Methyl 3-formylbenzoate52178-50-455 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.