3-Amino-6-methyl-4-(trifluoromethyl)thieno[2,3-B]pyridine-2-carbonitrile
Properties
- Molecular formula
- C10H6F3N3S
- Molar mass
- 257.23 g/mol
- Exact mass
- 257.0235 Da
- logP
- 3.08Crippen estimate
- Polar surface area
- 62.7 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 0
Hazards
Warning
- H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled100% of notifiers
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled100% 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
317840-08-7SMILES
CC1=CC(=C2C(=C(SC2=N1)C#N)N)C(F)(F)FInChIKey
XJKNYGYNTGJUJP-UHFFFAOYSA-NInChI
InChI=1S/C10H6F3N3S/c1-4-2-5(10(11,12)13)7-8(15)6(3-14)17-9(7)16-4/h2H,15H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-Amino-6-methyl-4-(trifluoromethyl)thieno[2,3-B]pyridine-2-carbonitrile
Similar compounds
3-Amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-B]pyridine-2-carbonitrile104960-55-666 % similar
2-Amino-3-(trifluoromethyl)benzonitrile58458-14-336 % similar
5-Amino-3-(trifluoromethyl)picolinonitrile573762-62-635 % similar
2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile13600-42-534 % similar
2,6-Dichloro-4-(trifluoromethyl)pyridin-3-amine175277-67-533 % similar
4-Methyl-3-(trifluoromethyl)benzonitrile261952-06-133 % similar
2-Amino-5-cyanobenzotrifluoride327-74-233 % similar
4-Cyano-3-(trifluoromethyl)aniline654-70-633 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.