Text Search
Structure Search

1-(chloromethyl)-4-methoxy-2-(trifluoromethyl)benzene

1-(chloromethyl)-4-methoxy-2-(trifluoromethyl)benzene

CAS: 1260817-43-3

Formula: C9H8ClF3O

SMILES: COC1=CC(=C(CCl)C=C1)C(F)(F)F

IUPAC: 1-(chloromethyl)-4-methoxy-2-(trifluoromethyl)benzene

InChI: InChI=1S/C9H8ClF3O/c1-14-7-3-2-6(5-10)8(4-7)9(11,12)13/h2-4H,5H2,1H3

Composition: C (48.13%), H (3.59%), Cl (15.78%), F (25.38%), O (7.12%)

Molar Mass: 224.61

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 224.0215771
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey XFBKUUQFEIZZQY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.36
Topological Polar Surface Area 9.23
Polarizability 17.78
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 1260817-43-3 Quote Only
Request Quote
Struchem co.,ltd
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1260817-43-3 $1,540.00-$3,414.00$1,540.00$2,100.00$3,414.00
Request Quote