Basic information
- CAS
20294-63-7- Standard SMILES
Cc1cc(N=O)c(C)cc1O- InChIKey
QYWLKBSOXZNRBF-UHFFFAOYSA-N- Molecular formula
- C8H9NO2
- Average molar mass
- 151.16 g/mol
- Monoisotopic mass
- 151.06332853
Names & identifiers
- Preferred name
- 2,5-Dimethyl-4-nitrosophenol
- IUPAC
- 2,5-dimethyl-4-nitrosophenol
- English name
- 2,5-diMethyl-4-nitrosophenol
- Molecular formula
- C8H9NO2
- Molecular weight
- 151.16
Names & synonyms
2,5-dimethyl-4-nitrosophenol20294-63-72593-53-5MLS002920121Phenol, 2,5-dimethyl-4-nitroso-NSC1316464-Nitroso-2,5-xylenolSCHEMBL9464262SCHEMBL30903400DTXSID30299622QYWLKBSOXZNRBF-UHFFFAOYSA-NNSC286491
Show more names
AKOS005145252NSC-131646NSC-2864912,5-dimethyl-[1,4]-benzoquinone oximeSMR001797718DB-355295F20968
Database identifiers
- CAS
20294-63-7、2593-53-5- PubChem CID
- 280208
- DTXSID
DTXSID30299622
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Melting point
- 162 °C · 162 °C (decomp)
- Boiling point
- 314.4 · 314.4±42.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- pka
- 7.01 · 7.01±0.23(Predicted)
Chemistry & industry
Suppliers16 total
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
济南精合医药科技有限公司0531-88811783 · [email protected]
南京芊亿达新材料科技有限公司15384069853 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
上海策嵘生物科技有限公司（定制合成实验室）13917420128 13062833949 · [email protected]
上海相辉医药科技有限公司[email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
上海晶石医药科技有限公司021-000000 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
1 records
Compound notes
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