CAS 143173-93-7 3-Amino-N-butylbenzenesulfonamide (HCID 5137973)

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Basic information

CAS: 143173-93-7
Standard SMILES: CCCCNS(=O)(=O)c1cccc(N)c1
InChIKey: WGOUCTJBESOZIL-UHFFFAOYSA-N
Molecular formula: C10H16N2O2S
Average molar mass: 228.31 g/mol
Monoisotopic mass: 228.09324875

Names & identifiers

Preferred name: 3-Amino-N-butylbenzenesulfonamide
IUPAC: 3-amino-N-butylbenzenesulfonamide
English name: 3-Amino-n-butylbenzenesulfonamide
Molecular formula: C10H16N2O2S
Molecular weight: 228.31

Names & synonyms

143173-93-73-Amino-N-butylbenzenesulfonamideRefChem:497656620-788-5N-Butyl 3-AminobenzenesulfonamideMFCD001448613-Amino-N-ButYl-Benzenesulfonamide3-amino-N-butylbenzene-1-sulfonamideSCHEMBL922624DTXSID50408678[(3-aminophenyl)sulfonyl]butylamineTFA17393

Show more names

N''-BUTYLMETANILAMIDEN-Butyl 3-AMinobenzenesulfonaMide CAS3-AMINO-N-BUTYLBENZENESULFONAMIDE TECH&3-AMINO-N-BUTYLBENZENESULFONAMIDE USP/EP/BP

Benzenesulfonamide, 3-amino-N-butyl-AKOS000198913AB03912BS-26479DB-030468ST51038273EN300-18703SR-01000068123

Database identifiers

CAS: 143173-93-7
PubChem CID: 5137973
DTXSID: DTXSID50408678
EC Number: 620-788-5

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 80.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 5
Heavy atoms: 15
Formal charge: 0
Complexity: 272

Physicochemical properties

Melting point: 73 · 73-77 °C(lit.)
Boiling point: 401.6 · 401.6±47.0 °C(Predicted)
Density: 1.19 · 1.190±0.06 g/cm3(Predicted)
pka: 11.85 · 11.85±0.50(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk: 3
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
Hazard statements: H315-H319-H335
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P