2-Chloro-5-methyl-6-phenylpyridine-3-carbaldehyde
Basic information
- CAS
876345-31-2- Standard SMILES
Cc1cc(C=O)c(Cl)nc1-c1ccccc1- InChIKey
UYPSBTYRVUBXES-UHFFFAOYSA-N- Molecular formula
- C13H10ClNO
- Average molar mass
- 231.68 g/mol
- Monoisotopic mass
- 231.0450916
Names & identifiers
- Preferred name
- 2-Chloro-5-methyl-6-phenylpyridine-3-carbaldehyde
- IUPAC
- 2-chloro-5-methyl-6-phenylpyridine-3-carbaldehyde
- English name
- 2-Chloro-5-Methyl-6-phenylnicotinaldehyde
- Molecular formula
- C13H10ClNO
- Molecular weight
- 231.68
Names & synonyms
876345-31-22-Chloro-5-methyl-6-phenylpyridine-3-carbaldehydeDTXSID30826331RefChem:258986DTXCID507770732-Chloro-5-methyl-6-phenylnicotinaldehydeMFCD26724207SCHEMBL2849385UYPSBTYRVUBXES-UHFFFAOYSA-NAC1576AKOS023566717CS-11962
Show more names
3-Pyridinecarboxaldehyde, 2-chloro-5-methyl-6-phenyl-
DA-26450SY034214F7983062-chloro-5-methyl-6-phenyl-pyridine-3-carbaldehyde
Database identifiers
- CAS
876345-31-2- PubChem CID
- 71405693
- DTXSID
DTXSID30826331- Nikkaji
- J2.359.494C
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- Symbol(GHS)
- 6 · GHS06,GHS07
- Signal word
- Danger
- Hazard statements
- 301 · H301-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
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
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS07
- Hazard statements
- H301-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Related reactions
3 records
Compound notes
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