Basic information
- CAS
135-15-9- Standard SMILES
CCCCOc1ccc(OCCCC)c([N+](=O)[O-])c1- InChIKey
UVLGMZCLSQBSPZ-UHFFFAOYSA-N- Molecular formula
- C14H21NO4
- Average molar mass
- 267.32 g/mol
- Monoisotopic mass
- 267.14705815
Names & identifiers
- Preferred name
- 1,4-Dibutoxy-2-nitrobenzene
- IUPAC
- 1,4-dibutoxy-2-nitrobenzene
- English name
- 2,5-DI-N-BUTOXYNITROBENZENE
- Molecular formula
- C14H21NO4
- Molecular weight
- 267.32
Names & synonyms
1,4-Dibutoxy-2-nitrobenzene135-15-9EINECS 205-180-6DTXSID50159193NSC 133444RefChem:73218DTXCID0081684205-180-62,5-Di-n-butoxynitrobenzeneNSC133444Benzene,4-dibutoxy-2-nitro-1,4-dibutoxy-2-nitro-benzene
Show more names
1-NITRO-2,5-DIBUTOXYBENZENE2,5-Dibutoxy-1-nitrobenzeneHYDROQUINONE NITRODIBUTYL ETHER1,4-DI-N-BUTOXY-2-NITROBENZENE, 98%
SCHEMBL6679715UVLGMZCLSQBSPZ-UHFFFAOYSA-NBenzene, 1,4-dibutoxy-2-nitro-AKOS022180932NSC-133444CS-0444901NS00024379ST50407462
Database identifiers
- CAS
135-15-9- PubChem CID
- 67265
- DTXSID
DTXSID50159193- EC Number
- 205-180-6
- Nikkaji
- J154.707K
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 254
Physicochemical properties
- Boiling point
- 171 · 171-174 °C(Press: 1 Torr)
- Density
- 1.076 · 1.076±0.06 g/cm3(Predicted)
- CAS DataBase Reference
- 135 · 135-15-9
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
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
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers8 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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