Basic information
- CAS
1210-96-4- Standard SMILES
COc1cc(OC)c([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
FNFRSLVCFFJHEE-UHFFFAOYSA-N- Molecular formula
- C8H8N2O6
- Average molar mass
- 228.16 g/mol
- Monoisotopic mass
- 228.03823598
Names & identifiers
- Preferred name
- 1,5-Dimethoxy-2,4-dinitrobenzene
- IUPAC
- 1,5-dimethoxy-2,4-dinitrobenzene
- English name
- 1,5-Dimethoxy-2,4-dinitrobenzene
- Molecular formula
- C8H8N2O6
- Molecular weight
- 228.16
Names & synonyms
1,5-Dimethoxy-2,4-dinitrobenzene1210-96-4DTXSID20346795RefChem:221300DTXCID50297867FNFRSLVCFFJHEE-UHFFFAOYSA-NBenzene,1,5-dimethoxy-2,4-dinitro-1,5-dimethoxy-2,4-dinitro-benzeneMFCD004541702,4-dimethoxy-1,5-dinitrobenzeneSCHEMBL63700551,3-dimethoxy-4,6-dinitrobenzene
Show more names
4,6-dimethoxy-1,3-dinitrobenzeneAKOS003239249ST50979841H81305
Database identifiers
- CAS
1210-96-4- PubChem CID
- 615053
- DTXSID
DTXSID20346795- Nikkaji
- J775.649F
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 247
Physicochemical properties
- Melting point
- 155.4 °C · 155.4 °C
- Boiling point
- 410.4 · 410.4±40.0 °C(Predicted)
- Density
- 1.416 · 1.416±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers7 total
南京斯贝源医药科技有限公司+86-25-68710855, +86-25-68710897 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
郑州浩创新材料有限公司19139721821; 19139721821 · [email protected]
Related reactions
2 records
Compound notes
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