2-Amino-3-cyano-4,5-dimethylpyrrole
Properties
- Molecular formula
- C7H9N3
- Molar mass
- 135.17 g/mol
- Exact mass
- 135.0796 Da
- logP
- 1.09Crippen estimate
- Polar surface area
- 65.6 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Hazards
Warning
- H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled50% of notifiers
- H302 Harmful if swallowed50% of notifiers
- H312 Harmful in contact with skin50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H332 Harmful if inhaled50% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 2 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
21392-51-8SMILES
CC1=C(NC(=C1C#N)N)CInChIKey
QZVLATXNNPVXEJ-UHFFFAOYSA-NInChI
InChI=1S/C7H9N3/c1-4-5(2)10-7(9)6(4)3-8/h10H,9H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-Amino-3-cyano-4,5-dimethylpyrrole
Similar compounds
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2-Amino-6-methylbenzonitrile56043-01-732 % similar
2,5-Diamino-3,4-dicyanothiophene17989-89-831 % similar
4-Amino-5-cyanoimidazole5098-11-331 % similar
2,3-Dimethylindole91-55-431 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.