Basic information
- CAS
3027-43-8- Standard SMILES
CC(=O)c1cccc2c(C(C)=O)cccc12- InChIKey
XWZKPVAYNUXKCZ-UHFFFAOYSA-N- Molecular formula
- C14H12O2
- Average molar mass
- 212.24 g/mol
- Monoisotopic mass
- 212.08372962
Names & identifiers
- Preferred name
- 1,5-Diacetylnaphthalene
- IUPAC
- 1-(5-acetylnaphthalen-1-yl)ethanone
- English name
- 1-(5-acetylnaphthalen-1-yl)ethanone
- Molecular formula
- C14H12O2
- Molecular weight
- 212.24
Names & synonyms
1,5-Diacetylnaphthalene3027-43-8DTXSID90276974RefChem:73450DTXCID30228134XWZKPVAYNUXKCZ-UHFFFAOYSA-N1-(5-acetylnaphthalen-1-yl)ethanone1,1'-(Naphthalene-1,5-diyl)diethanone1-(5-acetylnaphthalen-1-yl)ethan-1-oneEthanone, 1,1'-(1,5-naphthalenediyl)bis-NSC2251,5-Diacetyl-naphthalin
Show more names
SCHEMBL7119411SCHEMBL38573232NSC-225AKOS025296189Ethanone,1,1-(1,5-naphthalenediyl)bis-DS-007613I849381,1'-(Naphthalene-1,5-diyl)bis(ethan-1-one)
Database identifiers
- CAS
3027-43-8- PubChem CID
- 219219
- DTXSID
DTXSID90276974- Nikkaji
- J80.619F
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 265
Physicochemical properties
- HS Code
- 2914390090 · 2914390090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2914390090
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
吉林中科研伸科技有限公司043180534350 19917294565 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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