4-Amino-2-fluorobenzonitrile
Properties
- Molecular formula
- C7H5FN2
- Molar mass
- 136.13 g/mol
- Exact mass
- 136.0437 Da
- logP
- 1.28Crippen estimate
- Polar surface area
- 49.8 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 0
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H335 May cause respiratory irritation50% of notifiers
- H341 Suspected of causing genetic defects50% of notifiers
- H412 Harmful to aquatic life with long lasting effects50% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
53312-80-4SMILES
N#Cc1ccc(N)cc1FInChIKey
FDUGOYTWYJZNNP-UHFFFAOYSA-NInChI
InChI=1S/C7H5FN2/c8-7-3-6(10)2-1-5(7)4-9/h1-3H,10H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Benzonitrile, 4-amino-2-fluoro-
- 2-Fluoro-4-aminobenzonitrile
- 4-Cyano-3-fluoroaniline
Work with 4-Amino-2-fluorobenzonitrile
Similar compounds
5-Amino-2-fluorobenzonitrile53312-81-572 % similar
4-Amino-1,2-benzenedicarbonitrile56765-79-864 % similar
2-Fluoro-1,4-benzenedicarbonitrile1897-53-660 % similar
2,4-Difluorobenzonitrile3939-09-160 % similar
2-Fluoro-4-hydroxybenzonitrile82380-18-558 % similar
4-Bromo-2-fluorobenzonitrile105942-08-356 % similar
2-Fluoro-4-iodobenzonitrile137553-42-556 % similar
4-Amino-2-chlorobenzonitrile20925-27-356 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.