Basic information
- CAS
269-43-2- Standard SMILES
c1ccc2cc3c(cc2c1)OCO3- InChIKey
NWRWWWMEZJKVCS-UHFFFAOYSA-N- Molecular formula
- C11H8O2
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.05242949
Overview
structure
Names & identifiers
- Preferred name
- 2,3-Methylenedioxynaphthalene
- IUPAC
- benzo[f][1,3]benzodioxole
Names & synonyms
269-43-22,3-Methylenedioxynaphthalenebenzo[f][1,3]benzodioxoleNaphtho(2,3-d)-1,3-dioxoleNaphtho[2,3-d]-1,3-dioxoleF2X5FA64WENSC-133610AI3-29746DTXSID60181405benzo(f)(1,3)benzodioxoleRefChem:81921DTXCID30103896
Show more names
naphtho[2,3-d][1,3]dioxoleMFCD000877992H-naphtho[2,3-d][1,3]dioxoleNSC 133610UNII-F2X5FA64WESCHEMBL1840582SCHEMBL3138976SCHEMBL3142725
Database identifiers
- CAS
269-43-2- PubChem CID
- 97583
- DTXSID
DTXSID60181405- UNII
- F2X5FA64WE
- EC Number
- 653-433-8
- Nikkaji
- J1.672.406H
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 173
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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