Text Search
Structure Search

5-(4-tert-butylphenoxymethyl)-2-chloro-1,3-thiazole

5-(4-tert-butylphenoxymethyl)-2-chloro-1,3-thiazole

CAS: 339018-34-7

Formula: C14H16ClNOS

SMILES: CC(C)(C)C1=CC=C(OCC2=CN=C(Cl)S2)C=C1

IUPAC: 5-[(4-tert-butylphenoxy)methyl]-2-chloro-1,3-thiazole

InChI: InChI=1S/C14H16ClNOS/c1-14(2,3)10-4-6-11(7-5-10)17-9-12-8-16-13(15)18-12/h4-8H,9H2,1-3H3

Composition: C (59.67%), H (5.72%), Cl (12.58%), N (4.97%), O (5.68%), S (11.38%)

Molar Mass: 281.8

Atom Count: 34

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 281.064113
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey RXFLNGHIVSQCIL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.82
Topological Polar Surface Area 22.12
Polarizability 29.49
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 339018-34-7 $51.35-$86.31$51.35$63.37$86.31
Request Quote