4-Amino-N-ethylbenzenesulfonamide

C₈H₁₂N₂O₂SCAS 1709-53-1200.26 g/mol

Open in Covalent MOL file

Primary amine Sulfonamide

Properties

Molecular formula: C₈H₁₂N₂O₂S
Molar mass: 200.26 g/mol
Exact mass: 200.0619 Da
Melting point: 106 °C
logP: 0.57Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation100% 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

1709-53-1

SMILES

CCNS(=O)(=O)c1ccc(N)cc1

InChIKey

FDZPXCJOUIWRII-UHFFFAOYSA-N

InChI

InChI=1S/C8H12N2O2S/c1-2-10-13(11,12)8-5-3-7(9)4-6-8/h3-6,10H,2,9H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

Benzenesulfonamide, 4-amino-N-ethyl-
Sulfanilamide, N1-ethyl-
N1-Ethylsulfanilamide

Work with 4-Amino-N-ethylbenzenesulfonamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Ethyl-4-methylbenzenesulfonamide80-39-765 % similar 4,4′-Diaminobenzenesulfonanilide16803-97-758 % similar 3-Amino-N-ethyl-4-hydroxybenzenesulfonamide41606-61-555 % similar 4-Amino-N-(furan-2-ylmethyl)benzene-1-sulfonamide5626-92-654 % similar N-(4-Aminophenyl)-4-methylbenzenesulfonamide6380-08-153 % similar Sulfamethizole144-82-150 % similar Sulfamethazine57-68-149 % similar Sulfaguanidine57-67-049 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Amino-N-methylbenzenemethanesulfonamide109903-35-7 1,1-Dimethylethyl N-4-thiazolylcarbamate1235406-42-4 4-Amino-N,N-dimethylbenzenesulfonamide1709-59-7 4-(2-Aminoethyl)benzenesulfonamide35303-76-5 1,3-Diethyl-2-thiobarbituric acid5217-47-0

Elsewhere

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