(2,3-Dimethoxyphenyl)(4-pyridinyl)methanol

HCID 314742
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
243640-27-9
Standard SMILES
COc1cccc(C(O)c2ccncc2)c1OC
InChIKey
IRFMPRSXHIYMRM-UHFFFAOYSA-N
Molecular formula
C14H15NO3
Average molar mass
245.27 g/mol
Monoisotopic mass
245.10519334

Names & identifiers

Preferred name
(2,3-Dimethoxyphenyl)(4-pyridinyl)methanol
IUPAC
(2,3-dimethoxyphenyl)-pyridin-4-ylmethanol
English name
(2,3-DIMETHOXY-PHENYL)-PYRIDIN-4-YL-METHANOL
Molecular formula
C14H15NO3
Molecular weight
245.27

Names & synonyms

(2,3-dimethoxyphenyl)(4-pyridinyl)methanol243640-27-9(2,3-dimethoxyphenyl)(pyridin-4-yl)methanol(2,3-dimethoxyphenyl)-pyridin-4-ylmethanolMFCD04966948NSC234298Oprea1_631053(2,3-DIMETHOXY-PHENYL)-PYRIDIN-4-YL-METHANOL4-[1-hydroxy-1-(2,3-dimethoxyphenyl)methyl]pyridineSCHEMBL4225441DTXSID70310921IRFMPRSXHIYMRM-UHFFFAOYSA-N
Show more names
α-(2,3-Dimethoxyphenyl)-4-pyridinemethanol4-Pyridinemethanol, α-(2,3-dimethoxyphenyl)-
SBB100000AKOS001476053NSC-234298SS-2983(2,3-dimethoxyphenyl)-(4-pyridyl)methanol(2,3-dimethoxyphenyl)-4-pyridylmethan-1-olCS-0357126

Database identifiers

CAS
243640-27-9
PubChem CID
314742
DTXSID
DTXSID70310921
EC Number
607-362-4

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
51.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
18

Physicochemical properties

Boiling point
423.3 · 423.3±45.0 °C(Predicted)
Density
1.177 · 1.177±0.06 g/cm3(Predicted)
pka
12.44 · 12.44±0.20(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335

Safety & regulation

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Suppliers2 total

武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]

Related reactions

30 records
New reaction record

Compound notes

Loading…