N'-Methylnicotinamide
Grundinformationen
- CAS
114-33-0- Standard-SMILES
CNC(=O)c1cccnc1- InChIKey
ZYVXHFWBYUDDBM-UHFFFAOYSA-N- Summenformel
- C7H8N2O
- Durchschnittliche Molmasse
- 136,15 g/mol
- Monoisotopische Masse
- 136,06366288
Überblick
N-methylnicotinamide is a pyridinecarboxamide that is nicotinamide in which one of the amide hydrogens is substituted by a methyl group. It has a role as a metabolite. It is functionally related to a nicotinamide.
Namen und Bezeichner
- Bevorzugter Name
- N'-Methylnicotinamide
- IUPAC
- N-methylpyridine-3-carboxamide
- Englischer Name
- N-Methylnicotinamide
- Summenformel
- C7H8N2O
- Molmasse
- 136.15
Namen und Synonyme
N-Methylnicotinamide114-33-0N-methylpyridine-3-carboxamideNicotinic acid methylamide3-(Methylcarbamoyl)pyridineNicotinyl MethylamideN-Methyl-3-pyridinecarboxamideN'-Methylnicotinamide3-(N-Methylcarbamoyl)pyridineNicotinamide, N-methyl-N-Methyl nicotineamideNSC-66521
Weitere Namen anzeigen
3-Pyridinecarboxamide, N-methyl-MethylnicotinamideMETHYLNICOTINAMIDE, N-N-Methylnicotinamide>Nicotinamide Impurity 7N-Methylnicotinamide,98%Nicotinamide Impurity 121
X3I82S5L8IN-Methyl-nicotinamideDTXSID00870467SR-4415CHEBI:64399RefChem:163867DTXCID20818189204-046-4
Datenbank-Bezeichner
- CAS
114-33-0- PubChem CID
- 64950
- DTXSID
DTXSID00870467- ChEMBL
CHEMBL11978
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0
- Polarare Oberfläche (TPSA)
- 42 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 125
Experimentelle und physikochemische Eigenschaften
CosmeticsPersonal care product
SpringerMaterials PropertiesDensity
LogP
0.00
0.0
Melting Point103.5 °C
Physical DescriptionSolid
Physikochemische Eigenschaften
- Schmelzpunkt
- 102 · 102-105 °C(lit.)
- Siedepunkt
- 250.42 °C · 250.42°C (rough estimate)
- Dichte
- 1.1778 · 1.1778 (rough estimate)
- Brechungsindex
- 1.5769 · 1.5769 (estimate)
- storage temp.
- Inert atmosphere,Room Temperature
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information3-Pyridinecarboxamide, N-methyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2933.39.9200
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
Chemie und Industrie
Pharmakologische Informationen
ATC Code
A - Alimentary tract and metabolism
QA - Alimentary tract and metabolism
Absorption, Distribution and ExcretionN-methylnicotinamide is excreted in the urine.
Cellular LocationsCytoplasm
Anwendungen
VerwendenN-Methylnicotinamide is a metabolite of Nicotinamide (N407750), which is a water-soluble vitamin B, incorporated within nicotinamide cofactors such as NADH and NADPH. N-Methylnicotinamide is commonly found in the human urine and is used as a biomarker to study diseases such as liver cirrhosis and type 2 diabetes.
Anbieter100 Anbieter
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd
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