N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide

HCID 736837CAS 86847-64-5
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Grundinformationen

Standard-SMILES
CC(C)(C)C(=O)Nc1ncccc1C=O
InChIKey
ANABHCSYKASRRW-UHFFFAOYSA-N
Summenformel
C11H14N2O2
Durchschnittliche Molmasse
206,24 g/mol
Monoisotopische Masse
206,10552769

Namen und Bezeichner

Bevorzugter Name
N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide
IUPAC
N-(3-formyl-2-pyridinyl)-2,2-dimethylpropanamide
Englischer Name
N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide
Summenformel
C11H14N2O2
Molmasse
206.24

Namen und Synonyme

N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamideRefChem:826591625-350-786847-64-5N-(3-formylpyridin-2-yl)pivalamideN-(3-formylpyridin-2-yl)-2,2-dimethylpropanamideN-(3-Formyl-pyridin-2-yl)-2,2-dimethyl-propionamideMFCD018301702-PIVALYLAMINO-PYRIDINE-3-CARBOXYALDEHYDEN-(3-formyl(2-pyridyl))-2,2-dimethylpropanamideSCHEMBL1375331DTXSID30353117
Weitere Namen anzeigen
N-(3-Formyl-2-pyridinyl)pivalamideN-(3-FORMYL-2-PYRIDINYL)-2,2-DIMETHYLPR&N-(3-Formyl-2-pyridinyl)- tert-butanamide2-[(2,2-Dimethylpropanoyl)amino]nicotinaldehyden-(3-eormylpyridin-2-yl)-2,2-dimethylpropionamide
ANABHCSYKASRRW-UHFFFAOYSA-N3-formyl-2-(pivaloylamino)pyridineCS-M0436SBB093685AKOS000320285AB09960AS-35624BP-10381

Datenbank-Bezeichner

CAS
86847-64-5
PubChem CID
736837
DTXSID
DTXSID30353117
EC Number
625-350-7
Nikkaji
J329.300I

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,8
Polarare Oberfläche (TPSA)
59,1 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
3
Schwere Atome
15

Physikochemische Eigenschaften

Schmelzpunkt
85 · 85-88°C
storage temp.
2 · under inert gas (nitrogen or Argon) at 2-8°C
Aggregatzustand
solid
InChI
1S/C11H14N2O2/c1-11(2,3)10(15)13-9-8(7-14)5-4-6-12-9/h4-7H,1-3H3,(H,12,13,15)
InChIKey
ANABHCSYKASRRW-UHFFFAOYSA-N
SMILES
CC(C)(C)C(=O)Nc1ncccc1C=O

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (88.6%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Skin Sens. 1 (88.6%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

Sicherheitsdaten

wgk
3
hs_code
29333990
risk_code
36/37/38-43
hazard_code
Xi
safety_code
26-36/37
hazard_class
IRRITANT

Chemie und Industrie

Anwendungen

VerwendenReactant for:• ;Preparation of disubstituted azaindolines1

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海炎泽化工有限公司15345144255 19975051755 · [email protected]
成都市久鼎化学技术有限公司18584079237 · [email protected]
安特希（苏州）生物科技有限公司19951207836
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

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