Basic information
- CAS
51385-93-4- Standard SMILES
COc1ccc2ccc(OC)c(C=O)c2c1- InChIKey
PTTJQHKRNJYUGV-UHFFFAOYSA-N- Molecular formula
- C13H12O3
- Average molar mass
- 216.23 g/mol
- Monoisotopic mass
- 216.07864424
Names & identifiers
- Preferred name
- 2,7-Dimethoxy-1-naphthaldehyde
- IUPAC
- 2,7-dimethoxynaphthalene-1-carbaldehyde
- English name
- ASISCHEM R28379
- Molecular formula
- C13H12O3
- Molecular weight
- 216.23
Names & synonyms
2,7-dimethoxy-1-naphthaldehyde51385-93-42,7-dimethoxynaphthalene-1-carbaldehydeMFCD00453091NSC1595542,7-DimethoxynaphthaldehydeSCHEMBL5227187DTXSID10303650PTTJQHKRNJYUGV-UHFFFAOYSA-N2,7-dimethoxynaphthalenecarbaldehydeBBL023451STK387643
Show more names
ASISCHEM R28379CHEMBRDG-BB 64426952,7-Dimethoxy-1-naphthalenecarboxaldehyde1-Naphthalenecarboxaldehyde, 2,7-dimethoxy-2,7-dimethoxy-1-naphthaldehyde(SALTDATA: FREE)
AKOS000113261NSC-1595542,7-dimethoxy-naphthalene-1-carbaldehydeVS-07433DB-181694CS-0117179ST50906786F314945
Database identifiers
- CAS
51385-93-4- PubChem CID
- 293215
- DTXSID
DTXSID10303650
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers4 total
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
淄博百极荣创医药科技有限公司0533-6092686 13371592196 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
5 records
Compound notes
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