2,6-Diisocyanatonaphthalene
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Basic information
- CAS
13753-49-6- Standard SMILES
O=C=Nc1ccc2cc(N=C=O)ccc2c1- InChIKey
FYSXOCIUZBBUNB-UHFFFAOYSA-N- Molecular formula
- C12H6N2O2
- Average molar mass
- 210.19 g/mol
- Monoisotopic mass
- 210.04292744
Names & identifiers
- Preferred name
- 2,6-Diisocyanatonaphthalene
- IUPAC
- 2,6-diisocyanatonaphthalene
- English name
- 2,6-Naphthalenediyldiisocyanate
- Molecular weight
- 0
Names & synonyms
2,6-Diisocyanatonaphthalene13753-49-6Naphthalene, 2,6-diisocyanato-2,6-NaphthalenediyldiisocyanateSCHEMBL108863DTXSID60611575FYSXOCIUZBBUNB-UHFFFAOYSA-N
Database identifiers
- CAS
13753-49-6- PubChem CID
- 21243483
- DTXSID
DTXSID60611575- Nikkaji
- J173.364H
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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