3-(4-Methoxyphenyl)-1H-pyrazole-4-carbaldehyde
Properties
- Molecular formula
- C11H10N2O2
- Molar mass
- 202.21 g/mol
- Exact mass
- 202.0742 Da
- logP
- 1.90Crippen estimate
- Polar surface area
- 55.0 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 3
Hazards
Danger
- H302 Harmful if swallowed93.1% of notifiers
- H315 Causes skin irritation100% of notifiers
- H318 Causes serious eye damage93.1% of notifiers
- H335 May cause respiratory irritation98.6% of notifiers
Aggregated from 72 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
199682-73-0SMILES
COC1=CC=C(C=C1)C2=C(C=NN2)C=OInChIKey
QSGGFCPKXTULQQ-UHFFFAOYSA-NInChI
InChI=1S/C11H10N2O2/c1-15-10-4-2-8(3-5-10)11-9(7-14)6-12-13-11/h2-7H,1H3,(H,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-(4-Methoxyphenyl)-1H-pyrazole-4-carbaldehyde
Similar compounds
3-Phenyl-1H-pyrazole-4-carbaldehyde26033-20-562 % similar
3-(4-Fluorophenyl)-1H-pyrazole-4-carboxaldehyde306936-57-262 % similar
3-(4-Chlorophenyl)-1H-pyrazole-4-carbaldehyde350997-67-062 % similar
4'-Methoxy-(1,1'-biphenyl)-4-carboxaldehyde52988-34-850 % similar
4-Anisaldehyde123-11-546 % similar
3-(Thiophen-2-yl)-1H-pyrazole-4-carbaldehyde26033-27-245 % similar
2-Bromo-4-methoxybenzaldehyde43192-31-045 % similar
2,5-Dimethoxybenzaldehyde93-02-745 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.