CAS
16726-67-3 Purity
98%
16726-67-3 Purity
98%
Inquiry Basket
4-Bromo-2,5-difluoronitrobenzene
CAS
167415-27-2
Catalog Number
ACM167415272
Category
Bromine Series
Molecular Weight
237.99
Molecular Formula
C6H2BrF2NO2
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
ZINC00160132, CID2736286, 167415-27-2
IUPAC Name
1-bromo-2,5-difluoro-4-nitrobenzene
Canonical SMILES
C1=C(C(=CC(=C1F)Br)F)[N+](=O)[O-]
InChI Key
GJFYMYJYPARISZ-UHFFFAOYSA-N
Boiling Point
262.4ºC at 760mmHg
Melting Point
55ºC
Flash Point
112.5ºC
Density
1.89g/cm³
Exact Mass
236.92400
Hazard Statements
Xi: Irritant;T: Toxic;
H-Bond Acceptor
4
H-Bond Donor
0
Safety Description
S26-S36/37/39
What is the molecular formula of 4-Bromo-2,5-difluoronitrobenzene?
The molecular formula of 4-Bromo-2,5-difluoronitrobenzene is C6H2BrF2NO2.
What is the molecular weight of 4-Bromo-2,5-difluoronitrobenzene?
The molecular weight of 4-Bromo-2,5-difluoronitrobenzene is 237.99 g/mol.
What is the IUPAC name of 4-Bromo-2,5-difluoronitrobenzene?
The IUPAC name of 4-Bromo-2,5-difluoronitrobenzene is 1-bromo-2,5-difluoro-4-nitrobenzene.
What is the InChI of 4-Bromo-2,5-difluoronitrobenzene?
The InChI of 4-Bromo-2,5-difluoronitrobenzene is InChI=1S/C6H2BrF2NO2/c7-3-1-5(9)6(10(11)12)2-4(3)8/h1-2H.
What is the InChIKey of 4-Bromo-2,5-difluoronitrobenzene?
The InChIKey of 4-Bromo-2,5-difluoronitrobenzene is GJFYMYJYPARISZ-UHFFFAOYSA-N.
What is the canonical SMILES of 4-Bromo-2,5-difluoronitrobenzene?
The canonical SMILES of 4-Bromo-2,5-difluoronitrobenzene is C1=C(C(=CC(=C1F)Br)F)[N+](=O)[O-].
What is the CAS number of 4-Bromo-2,5-difluoronitrobenzene?
The CAS number of 4-Bromo-2,5-difluoronitrobenzene is 167415-27-2.
What is the EPA DSSTox Substance ID of 4-Bromo-2,5-difluoronitrobenzene?
The EPA DSSTox Substance ID of 4-Bromo-2,5-difluoronitrobenzene is DTXSID20371249.
What is the XLogP3-AA value of 4-Bromo-2,5-difluoronitrobenzene?
The XLogP3-AA value of 4-Bromo-2,5-difluoronitrobenzene is 2.6.
Is 4-Bromo-2,5-difluoronitrobenzene a canonicalized compound?
Yes, 4-Bromo-2,5-difluoronitrobenzene is a canonicalized compound.
Recommended Products
