Basic information
- CAS
103392-84-3- Standard SMILES
CC(C)(C)c1ccc([N+](=O)[O-])cc1N- InChIKey
WDAPBIPOUWCMPK-UHFFFAOYSA-N- Molecular formula
- C10H14N2O2
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.10552769
Names & identifiers
- Preferred name
- 2-Tert-butyl-5-nitroaniline
- IUPAC
- 2-tert-butyl-5-nitroaniline
- English name
- 2-tert-Butyl-5-nitro-phenylamine
- Molecular formula
- C10H14N2O2
- Molecular weight
- 194.23
Names & synonyms
2-tert-butyl-5-nitroaniline103392-84-32-(tert-Butyl)-5-nitroaniline2-tert-butyl-5-nitro-anilineMFCD014638702-tert-butyl-5-nitro-phenylamine2-t-Butyl-5-nitroaniline5-Nitro-2-t-butylanilineOprea1_0868012-tert-butyl-5-nitrobenzenamineSY167273EN300-196852
Show more names
2-Tert-Butyl-5-Nitroaniline(WX602011)2-tert-butyl-5-nitro-aniline - [B81171]Benzenamine, 2-(1,1-dimethylethyl)-5-nitro-
5-nitro-2-tert-bu5-nitro-2-tert-butylanilineSCHEMBL395023DTXSID60356550WDAPBIPOUWCMPK-UHFFFAOYSA-N2-(tert-butyl)-5-nitrophenylamineDEA39284SBB091753
Database identifiers
- CAS
103392-84-3- PubChem CID
- 826103
- DTXSID
DTXSID60356550- EC Number
- 190-852-0
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Boiling point
- 334.7 · 334.7±30.0 °C(Predicted)
- Density
- 1.14 · 1.140±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 1.69 · 1.69±0.10(Predicted)
- form
- solid
- color
- yellow
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-37/39
Safety & regulation
Safety data
- risk_code
- 36/37/38
- Signal word
- Warning
- safety_code
- 26-37/39
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers18 total
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
Related reactions
113 records
Compound notes
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