CAS 119082-98-3 5-(2-Pyridinyl)-2-thiophenecarbonyl chloride (HCID 2776199)

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Basic information

CAS: 119082-98-3
Standard SMILES: O=C(Cl)c1ccc(-c2ccccn2)s1
InChIKey: NAWHORNTKSFUCQ-UHFFFAOYSA-N
Molecular formula: C10H6ClNOS
Average molar mass: 223.68 g/mol
Monoisotopic mass: 222.9858627

Names & identifiers

Preferred name: 5-(2-Pyridinyl)-2-thiophenecarbonyl chloride
IUPAC: 5-pyridin-2-ylthiophene-2-carbonyl chloride
English name: 5-(2-Pyridinyl)-2-thiophenecarbonyl chloride
Molecular formula: C10H6ClNOS
Molecular weight: 223.68

Names & synonyms

119082-98-35-(2-PYRIDINYL)-2-THIOPHENECARBONYL CHLORIDE5-(Pyridin-2-yl)thiophene-2-carbonyl chlorideDTXSID40379883RefChem:529633DTXCID90330909640-794-15-pyridin-2-ylthiophene-2-carbonyl chloride2-Thiophenecarbonyl chloride, 5-(2-pyridinyl)-MFCD020915015-(2-pyridyl)thiophene-2-carbonyl chloride2-Thiophenecarbonylchloride, 5-(2-pyridinyl)-

Show more names

AKOS BAR-2290BUTTPARK 29\06-242-(Chlorocarbonyl)-5-(pyridin-2-yl)thiophene5-(Pyridin-2-yl)-2-thiophenecarbonyl chloride

SCHEMBL193466NAWHORNTKSFUCQ-UHFFFAOYSA-NSBB096572AKOS004116957SB67110DB-010930CS-04418635-(2-Pyridinyl)thiophene-2-carbonyl chloride

Database identifiers

CAS: 119082-98-3
PubChem CID: 2776199
DTXSID: DTXSID40379883
EC Number: 640-794-1

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 58.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 224

Physicochemical properties

Melting point: 142 · 142-143°C
Boiling point: 362.1 · 362.1±32.0 °C(Predicted)
Density: 1.365 · 1.365±0.06 g/cm3(Predicted)
pka: 2.82 · 2.82±0.19(Predicted)
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Hazard Codes: C
Risk Statements: 34 · 34
Safety Statements: 26 · 26-36/37/39
RIDADR: 3261 · 3261
Hazard Note: Irritant
HS Code: 2934999090 · 2934999090

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (100%)

Safety data

ridadr: 3261
hs_code: 2934999090
risk_code: 34
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: C
hazard_note: Irritant
safety_code: 26-36/37/39
Hazard statements: H314
Precautionary statements: P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501