4-(4-Methoxyphenyl)pyridine

HCID 603813CAS 5938-16-9
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(-c2ccncc2)cc1
InChIKey
BDXPUDLCSHDVGK-UHFFFAOYSA-N
Molecular formula
C12H11NO
Average molar mass
185.22 g/mol
Monoisotopic mass
185.08406397

Names & identifiers

Preferred name
4-(4-Methoxyphenyl)pyridine
IUPAC
4-(4-methoxyphenyl)pyridine
English name
4-(4-Methoxyphenyl)pyridine
Molecular formula
C12H11NO
Molecular weight
185.22

Names & synonyms

4-(4-Methoxyphenyl)pyridine5938-16-9DTXSID30345335RefChem:288129DTXCID802964094-(4-Methoxy-phenyl)-pyridineMFCD000923314-(4-Methoxyphenyl)-pyridinePyridine, 4-(4-methoxyphenyl)-Pyridine, 4-[4-methoxyphenyl]-4-(4-methoxylphenyl)pyridineAKOS BAR-0614
Show more names
SCHEMBL249089SCHEMBL40943564-(4-Methoxyphenyl)pyridine #SCHEMBL287840844-(4-Methoxyphenyl)pyridine, 97%AKOS004117452DS-2097FS-3581

Database identifiers

CAS
5938-16-9
PubChem CID
603813
DTXSID
DTXSID30345335
Nikkaji
J1.479.754H

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
22.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14

Physicochemical properties

Melting point
38 · 38-63 °C
Boiling point
160 · 160-180 °C(Press: 0.5 Torr)
Density
1.077 · 1.077±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
pka
5.9 · 5.90±0.10(Predicted)
Appearance
White to off-white Solid

Safety & regulation

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Suppliers49 total

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
安特希（苏州）生物科技有限公司19951207836

Related reactions

14 records
New reaction record

Linked notes

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