Basic information
- CAS
57748-41-1- Standard SMILES
O=Cc1ccc(OCc2ccccn2)cc1- InChIKey
MKHNUKSZFMWQJL-UHFFFAOYSA-N- Molecular formula
- C13H11NO2
- Average molar mass
- 213.23 g/mol
- Monoisotopic mass
- 213.07897859
Names & identifiers
- Preferred name
- 4-(Pyridin-2-ylmethoxy)benzaldehyde
- IUPAC
- 4-(pyridin-2-ylmethoxy)benzaldehyde
- English name
- 4-(2-Pyridinylmethoxy)benzaldehyde
- Molecular formula
- C13H11NO2
- Molecular weight
- 213.23
Names & synonyms
4-(pyridin-2-ylmethoxy)benzaldehyde57748-41-1DTXSID80353965RefChem:289406DTXCID603050284-(2-pyridinylmethoxy)benzaldehyde4-(Pyridin-2-ylmethoxy)-benzaldehyde4-[(pyridin-2-yl)methoxy]benzaldehydeMFCD004697624-(2-pyridylmethoxy)benzaldehydeOprea1_428918Oprea1_804320
Show more names
AKOS BB922ASISCHEM C31355TIMTEC-BB SBB011280CHEMBRDG-BB 4003169UKRORGSYN-BB BBV-062386Benzaldehyde, 4-(2-pyridinylmethoxy)-4-(pyridin-2-ylmethoxy)benzaldehyde(SALTDATA: FREE)
MLS000526350SCHEMBL509499CHEMBL1411498SCHEMBL27796956MKHNUKSZFMWQJL-UHFFFAOYSA-NHMS2495G13CS-D0185HCA74841
Database identifiers
- CAS
57748-41-1- PubChem CID
- 759667
- DTXSID
DTXSID80353965- ChEMBL
CHEMBL1411498
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 212
Physicochemical properties
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- white solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers12 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
成都优硕生物科技有限公司13693449011 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
南京凯姆铂医药科技有限公司025-66162170
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
17 records
Compound notes
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