Basic information
- CAS
7250-52-4- Standard SMILES
Cc1ccncc1C(N)=O- InChIKey
SXKLOQCGXUTBNP-UHFFFAOYSA-N- Molecular formula
- C7H8N2O
- Average molar mass
- 136.15 g/mol
- Monoisotopic mass
- 136.06366288
Overview
structure given in first source
Names & identifiers
- Preferred name
- 4-Methyl-3-pyridinecarboxamide
- IUPAC
- 4-methylpyridine-3-carboxamide
- English name
- 4-Methyl-3-pyridinecarboxamide
- Molecular formula
- C7H8N2O
- Molecular weight
- 136.15
Names & synonyms
4-Methylnicotinamide7250-52-44-Methyl-3-pyridinecarboxamideDTXSID90222815RefChem:912671DTXCID201453064-methylpyridine-3-carboxamide3-Pyridinecarboxamide, 4-methyl-MFCD00234322MLS000737610CHEMBL1501622NSC-30041
Show more names
Nicotinamide Impurity 1304-Methyl-3-pyridinecarboxamide ISO 9001：2015 REACH
3-Pyridinecarboxamide,4-methyl-(9CI)4-Methylpyridine-3-formamideNicotinamide 4-Methyl ImpuritySCHEMBL1265706SCHEMBL15415600SCHEMBL20490992SCHEMBL29682389HMS2748O15
Database identifiers
- CAS
7250-52-4- PubChem CID
- 95692
- DTXSID
DTXSID90222815- ChEMBL
CHEMBL1501622- EC Number
- 615-775-6
- Nikkaji
- J285.116D
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 56 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 136
Physicochemical properties
- Melting point
- 167 · 167-167.5 °C(Solv: ethanol (64-17-5))
- Boiling point
- 294.1 · 294.1±28.0 °C(Predicted)
- Density
- 1.157 · 1.157±0.06 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 14.85 · 14.85±0.50(Predicted)
- color
- White to Off-White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 233 · P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Chemistry & industry
Applications
Uses4-Methylnicotinamide, is an intermediate in the synthesis of various pharmaceutical compounds. It can be used in the preparation of various pyrimidine and pyridine derivatives, possessing antitumor cell activity.
Suppliers45 total
杭州品高化工有限公司0571-87658025 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
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杭州摩库生物医药科技有限公司400-711-5280 86-571-81025280 · [email protected]
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Alchem Pharmtech,Inc.8485655694 · [email protected]
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HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
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珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
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Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Related reactions
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Compound notes
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