Text Search
Structure Search

1-fluoro-2-methoxy-5-methyl-3-nitrobenzene

1-fluoro-2-methoxy-5-methyl-3-nitrobenzene

CAS: 708-04-3

Formula: C8H8FNO3

SMILES: COC1=C(F)C=C(C)C=C1[N+]([O-])=O

IUPAC: 1-fluoro-2-methoxy-5-methyl-3-nitrobenzene

InChI: InChI=1S/C8H8FNO3/c1-5-3-6(9)8(13-2)7(4-5)10(11)12/h3-4H,1-2H3

Composition: C (51.90%), H (4.36%), F (10.26%), N (7.57%), O (25.92%)

Molar Mass: 185.154

Atom Count: 21

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 185.048821285
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey JRWSBCXFFPZMRL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.1
Topological Polar Surface Area 52.37
Polarizability 16.29
Ring Count 1
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Key Organics Ltd
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 708-04-3 $314.64-$690.46$314.64$314.64$690.46$690.46
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 708-04-3 $85.75-$208.07$85.75$208.07
Request Quote