Basic information
- CAS
52549-07-2- Standard SMILES
O=C(O)Cc1ccc2c(c1)Cc1cccnc1O2- InChIKey
KFCLXFOOVXFBNL-UHFFFAOYSA-N- Molecular formula
- C14H11NO3
- Average molar mass
- 241.24 g/mol
- Monoisotopic mass
- 241.07389321
Names & identifiers
- Preferred name
- 2-(5H-chromeno[2,3-b]pyridin-7-yl)acetic acid
- IUPAC
- 2-(5H-chromeno[2,3-b]pyridin-7-yl)acetic acid
- English name
- 5H-chroMeno[2,3-b]pyridin-7-ylacetic acid
- Molecular formula
- C14H11NO3
- Molecular weight
- 241.24
Names & synonyms
52549-07-22-(5H-chromeno[2,3-b]pyridin-7-yl)acetic acid5H-chromeno[2,3-b]pyridin-7-ylacetic acidMLS003115531NSC281724Pranoprofen Impurity N3SCHEMBL9790203CHEMBL2138347DTXSID80314253KFCLXFOOVXFBNL-UHFFFAOYSA-NNSC-281724SMR001831106
Show more names
Praprofen Impurity 32Pranoprofen Impurity 65Pranoprofen Impurity 325H-[1]Benzopyrano[2,3-b]pyridine-7-acetic acid
(5H-[1]Benzopyrano[2,3-b]pyridin-7-yl)acetic acid5H-[1]benzopyrano[2,3-b]-pyridin-7-yl-acetic acid
Database identifiers
- CAS
52549-07-2- PubChem CID
- 323005
- DTXSID
DTXSID80314253- ChEMBL
CHEMBL2138347
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 320
Physicochemical properties
- Melting point
- 218 °C · 218 °C(Solv: 1,4-dioxane (123-91-1); water (7732-18-5))
- Boiling point
- 473.4 · 473.4±33.0 °C(Predicted)
- Density
- 1.356 · 1.356±0.06 g/cm3(Predicted)
- pka
- 4.26 · 4.26±0.10(Predicted)
Chemistry & industry
Suppliers20 total
济南百隆化学有限公司[email protected] · [email protected]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
深圳市洛克医药科技有限公司13128912434 · [email protected]
北京康派森医药科技有限公司010-010-52878169 15801002657 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
深圳卓越生物医药科技有限公司26050679 18318671572 · [email protected]
北京爱科姆科技有限公司17710328343 · [email protected]
扬州长华生物科技有限公司15189846850 13815846020 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
深圳市恒丰万达医药科技有限公司13986652530 · [email protected]
深圳晴天生物技术有限公司18823167005 18162969855 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
Related reactions
2 records
Compound notes
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