Basic information
- CAS
6082-87-7- Standard SMILES
O=C(O)c1ccccc1Oc1ccc([N+](=O)[O-])cc1- InChIKey
LZYVYVIQKXALAF-UHFFFAOYSA-N- Molecular formula
- C13H9NO5
- Average molar mass
- 259.21 g/mol
- Monoisotopic mass
- 259.04807239
Names & identifiers
- Preferred name
- 2-(4-Nitrophenoxy)benzoic acid
- IUPAC
- 2-(4-nitrophenoxy)benzoic acid
- English name
- 2-(4-Nitrophenoxy)benzenecarboxylic acid
- Molecular formula
- C13H9NO5
- Molecular weight
- 259.21
Names & synonyms
2-(4-nitrophenoxy)benzoic acid6082-87-7DTXSID10332586RefChem:252743DTXCID002836792-(4-nitrophenoxy)benzenecarboxylic acidMFCD010025072-(4-nitrophenoxy)benzoicacido-(o-Nitrophenoxy)benzoic acidSCHEMBL4452102o-carboxyphenyl p-nitrophenyl etherSBB102155
Show more names
AKOS BC-0775Benzoic acid, 2-(4-nitrophenoxy)-
AKOS004119749CS-0364643G783573X-0714F755223
Database identifiers
- CAS
6082-87-7- PubChem CID
- 458969
- DTXSID
DTXSID10332586
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 332
Physicochemical properties
- Melting point
- 154 · 154-157°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers11 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
Aladdin Scientific[email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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