Text Search
Structure Search

tert-butyl 2,4-difluorobenzoate

tert-butyl 2,4-difluorobenzoate

CAS: 500353-15-1

Formula: C11H12F2O2

SMILES: CC(C)(C)OC(=O)C1=C(F)C=C(F)C=C1

IUPAC: tert-butyl 2,4-difluorobenzoate

InChI: InChI=1S/C11H12F2O2/c1-11(2,3)15-10(14)8-5-4-7(12)6-9(8)13/h4-6H,1-3H3

Composition: C (61.68%), H (5.65%), F (17.74%), O (14.94%)

Molar Mass: 214.212

Atom Count: 27

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 214.080535952
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey NIADSGDBPFELPU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.32
Topological Polar Surface Area 26.3
Polarizability 19.71
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <10 Days 500353-15-1 Quote Only
Request Quote
Chemcia Scientific, LLC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 500353-15-1 $184.00-$678.50$184.00$678.50
Request Quote